Vitas-M small molecule compound
2-{[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzonitrile
Catalog ID
STK337594
SMILES N#Cc1ccccc1CSc1nnc(n1C)Cc1ccccc1
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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 C18H16N4S MW 320.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4S/c1-22-17(11-14-7-3-2-4-8-14)20-21-18(22)23-13-16-10-6-5-9-15(16)12-19/h2-10H,11,13H2,1H3InChIKey
YMTJHUJMYNQPNE-UHFFFAOYSA-NSynonyms
2(((5BENZYL4METHYL4H124TRIAZOL3YL)SULFANYL)METHYL)BENZONITRILE
2((5BENZYL4METHYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
CN1C(=NN=C1SCC2=CC=CC=C2C#N)CC3=CC=CC=C3
InChI=1SC18H16N4Sc12217(11147324814)202118(22)2313161065915(16)1219h210H1113H21H3
MFCD04332008
ZINC000005231086
ZINC05231086
ZINC5231086
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