Vitas-M small molecule compound

4-cyclohexyl-5-phenyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK356000
SMILES Sc1nnc(n1C1CCCCC1)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C14H17N3S MW 259.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3S/c18-14-16-15-13(11-7-3-1-4-8-11)17(14)12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,16,18)
InChIKey
VTLLUDFHDJESNU-UHFFFAOYSA-N
Synonyms
38942-57-3
38942573
4CYCLOHEXYL3PHENYL1H124TRIAZOLE5THIONE
4CYCLOHEXYL3PHENYL45DIHYDRO1H124TRIAZOLE5THIONE
4CYCLOHEXYL5PHENYL124TRIAZOLE3THIOL
4CYCLOHEXYL5PHENYL24DIHYDRO3H124TRIAZOLE3THIONE
4CYCLOHEXYL5PHENYL2H124TRIAZOLE3THIONE
4CYCLOHEXYL5PHENYL4H(124)TRIAZOLE3THIOL
4CYCLOHEXYL5PHENYL4H124TRIAZOL3YLHYDROSULFIDE
4CYCLOHEXYL5PHENYL4H124TRIAZOLE3THIOL
4H124TRIAZOLE3THIOL4CYCLOHEXYL5PHENYL
C1CCC(CC1)N2C(=NNC2=S)C3=CC=CC=C3
InChI=1SC14H17N3Sc1814161513(117314811)17(14)1295261012h1347812H256910H2(H1618)
MFCD01408815
ZINC000000276473
ZINC00276473
ZINC276473

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.