Vitas-M small molecule compound
2-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzonitrile
Catalog ID
STK135393
SMILES N#Cc1ccccc1CSc1nnc(n1C)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 C17H14N4S MW 306.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4S/c1-21-16(13-7-3-2-4-8-13)19-20-17(21)22-12-15-10-6-5-9-14(15)11-18/h2-10H,12H2,1H3InChIKey
VTPGCAMBQVGXLA-UHFFFAOYSA-NSynonyms
693253-91-72(((4METHYL5PHENYL4H124TRIAZOL3YL)SULFANYL)METHYL)BENZONITRILE
2((4METHYL5PHENYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
693253917
CN1C(=NN=C1SCC2=CC=CC=C2C#N)C3=CC=CC=C3
InChI=1SC17H14N4Sc12116(137324813)192017(21)2212151065914(15)1118h210H12H21H3
MFCD03876923
ZINC000000468679
ZINC00468679
ZINC468679
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