Phenyl-1,2,3-triazoles

Description:

Organic compounds containing a 1,2,3-triazole substituted by a phenyl group.

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  1. Carbamic acid, N-(5-((2-phenylethyl)((4-(4-(trifluoromethoxy)phenyl)-1H-1,2,3-triazol-1-yl)carbonyl)amino)pentyl)-, 1,1-dimethylethyl ester
    CAS: 1402612-61-6 Formula: C28H34F3N5O4 Molecular Weight: 561.600
    Out of Stock Item #: C963678
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    IUPAC Name
    tert-butyl N-[5-[2-phenylethyl-[4-[4-(trifluoromethoxy)phenyl]triazole-1-carbonyl]amino]pentyl]carbamate
    SMILES
    CC(C)(C)OC(=O)NCCCCCN(CCC1=CC=CC=C1)C(=O)N2C=C(N=N2)C3=CC=C(C=C3)OC(F)(F)F
    InChIKey
    NUWWTGPNHRKNPN-UHFFFAOYSA-N
    InChI
    1S/C28H34F3N5O4/c1-27(2,3)40-25(37)32-17-8-5-9-18-35(19-16-21-10-6-4-7-11-21)26(38)36-20-24(33-34-36)22-12-14-23(15-13-22)39-28(29,30)31/h4,6-7,10-15,show more
  2. 2-[4-(diethylamino)phenyl]-6-methyl-2H-1,2,3-benzotriazol-5-amine
    CAS: 381208-40-8 PubChem CID: 886736
    Out of Stock Item #: D1357446
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    IUPAC Name
    2-[4-(diethylamino)phenyl]-6-methylbenzotriazol-5-amine
    SMILES
    CCN(CC)C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)N)C
    InChIKey
    WRIPKYOZKAJHRL-UHFFFAOYSA-N
    InChI
    1S/C17H21N5/c1-4-21(5-2)13-6-8-14(9-7-13)22-19-16-10-12(3)15(18)11-17(16)20-22/h6-11H,4-5,18H2,1-3H3
  3. 1-(3-iodophenyl)-4-(3-nitrophenyl)-1H-1,2,3-triazole
    CAS: 1809031-84-2 PubChem CID: 122190591 Formula: C14H9IN4O2 Molecular Weight: 392.15
    Out of Stock Item #: I1005364
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    Technical Identifiers
    IUPAC Name
    1-(3-iodophenyl)-4-(3-nitrophenyl)triazole
    SMILES
    C1=CC(=CC(=C1)[N+](=O)[O-])C2=CN(N=N2)C3=CC(=CC=C3)I
    InChIKey
    LSVWEYNSNZJEGB-UHFFFAOYSA-N
    InChI
    1S/C14H9IN4O2/c15-11-4-2-5-12(8-11)18-9-14(16-17-18)10-3-1-6-13(7-10)19(20)21/h1-9H
  4. 4-chloro-2-(1H-1,2,3-triazol-4-yl)phenol
    CAS: 1378976-02-3 Formula: C8H6ClN3O Molecular Weight: 195.600
    Out of Stock Item #: C1010096
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    IUPAC Name
    4-chloro-2-(2H-triazol-4-yl)phenol
    SMILES
    C1=CC(=C(C=C1Cl)C2=NNN=C2)O
    InChIKey
    NBDFMTBYKCBTSW-UHFFFAOYSA-N
    InChI
    1S/C8H6ClN3O/c9-5-1-2-8(13)6(3-5)7-4-10-12-11-7/h1-4,13H,(H,10,11,12)
  5. 4-[1-(3-Chlorophenyl)-1H-1,2,3-triazole-4-carbonyl]thiomorpholine
    CAS: 951612-19-4 Formula: C13H13ClN4OS Molecular Weight: 308.790
    Out of Stock Item #: C1020959
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    IUPAC Name
    [1-(3-chlorophenyl)triazol-4-yl]-thiomorpholin-4-ylmethanone
    SMILES
    C1CSCCN1C(=O)C2=CN(N=N2)C3=CC(=CC=C3)Cl
    InChIKey
    ZOBDTKWDYMRKPF-UHFFFAOYSA-N
    InChI
    1S/C13H13ClN4OS/c14-10-2-1-3-11(8-10)18-9-12(15-16-18)13(19)17-4-6-20-7-5-17/h1-3,8-9H,4-7H2
  6. 5-(3-Chlorophenyl)-1H-1,2,3-triazole
    CAS: 35225-01-5 PubChem CID: 6409664 Formula: C8H6ClN3 Molecular Weight: 179.6
    Out of Stock Item #: H709828
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    Technical Identifiers
    IUPAC Name
    4-(3-chlorophenyl)-2H-triazole
    SMILES
    C1=CC(=CC(=C1)Cl)C2=NNN=C2
    InChIKey
    VLAULFMSWJFSFA-UHFFFAOYSA-N
    InChI
    1S/C8H6ClN3/c9-7-3-1-2-6(4-7)8-5-10-12-11-8/h1-5H,(H,10,11,12)
  7. 4-(2H-1,2,3-Triazol-2-yl)benzaldehyde
    CAS: 179056-04-3 Formula: C9H7N3O Molecular Weight: 173.17
    Out of Stock Item #: B725059
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    Technical Identifiers
    IUPAC Name
    4-(triazol-2-yl)benzaldehyde
    SMILES
    C1=CC(=CC=C1C=O)N2N=CC=N2
    InChIKey
    CTYWOTWHICQOMA-UHFFFAOYSA-N
    InChI
    1S/C9H7N3O/c13-7-8-1-3-9(4-2-8)12-10-5-6-11-12/h1-7H
    Synonyms
    4-[1,2,3]Triazol-2-yl-benzaldehyde
  8. 1-(3-Chlorophenyl)-1H-1,2,3-triazole-4-carboxylic acid
    CAS: 944901-58-0 PubChem CID: 28743193 Formula: C9H6ClN3O2 Molecular Weight: 223.61
    Out of Stock Item #: H731667
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    Technical Identifiers
    IUPAC Name
    1-(3-chlorophenyl)triazole-4-carboxylic acid
    SMILES
    C1=CC(=CC(=C1)Cl)N2C=C(N=N2)C(=O)O
    InChIKey
    OEXGDURKRPWFBF-UHFFFAOYSA-N
    InChI
    1S/C9H6ClN3O2/c10-6-2-1-3-7(4-6)13-5-8(9(14)15)11-12-13/h1-5H,(H,14,15)
  9. 4-(1H-1,2,3-triazol-1-yl)benzaldehyde
    CAS: 41498-10-6 PubChem CID: 10844943 Formula: C9H7N3O Molecular Weight: 173.17
    Out of Stock Item #: B725099
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    Technical Identifiers
    IUPAC Name
    4-(triazol-1-yl)benzaldehyde
    SMILES
    C1=CC(=CC=C1C=O)N2C=CN=N2
    InChIKey
    CUKGVKDSSJVBFD-UHFFFAOYSA-N
    InChI
    1S/C9H7N3O/c13-7-8-1-3-9(4-2-8)12-6-5-10-11-12/h1-7H
  10. 1-Benzyl-4-phenyl-1,2,3-triazole
    CAS: 108717-96-0 PubChem CID: 11310894 Formula: C15H13N3 Molecular Weight: 235.28
    Out of Stock Item #: B725821
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    Technical Identifiers
    IUPAC Name
    1-benzyl-4-phenyltriazole
    SMILES
    C1=CC=C(C=C1)CN2C=C(N=N2)C3=CC=CC=C3
    InChIKey
    GANAQXGHGKBVKP-UHFFFAOYSA-N
    InChI
    1S/C15H13N3/c1-3-7-13(8-4-1)11-18-12-15(16-17-18)14-9-5-2-6-10-14/h1-10,12H,11H2
  11. 1-(4-Amino-phenyl)-1,2,3-triazole
    CAS: 16279-88-2 PubChem CID: 15514364 Formula: C8H8N4 Molecular Weight: 160.18
    Out of Stock Item #: T728445
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    Technical Identifiers
    IUPAC Name
    4-(triazol-1-yl)aniline
    SMILES
    C1=CC(=CC=C1N)N2C=CN=N2
    InChIKey
    VBRMIWOLUCKNTN-UHFFFAOYSA-N
    InChI
    1S/C8H8N4/c9-7-1-3-8(4-2-7)12-6-5-10-11-12/h1-6H,9H2
  12. 4-(p-Tolyl)-1H-1,2,3-triazole
    CAS: 5301-96-2 PubChem CID: 594397 Formula: C9H9N3 Molecular Weight: 159.19
    Out of Stock Item #: H690863
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    Technical Identifiers
    IUPAC Name
    4-(4-methylphenyl)-2H-triazole
    SMILES
    CC1=CC=C(C=C1)C2=NNN=C2
    InChIKey
    ZPCIKQLLQORQCV-UHFFFAOYSA-N
    InChI
    1S/C9H9N3/c1-7-2-4-8(5-3-7)9-6-10-12-11-9/h2-6H,1H3,(H,10,11,12)
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