Vitas-M small molecule compound
2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzonitrile
Catalog ID
STK862744
SMILES N#Cc1ccccc1CSc1nnc(n1CC)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 C18H16N4S MW 320.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4S/c1-2-22-17(14-8-4-3-5-9-14)20-21-18(22)23-13-16-11-7-6-10-15(16)12-19/h3-11H,2,13H2,1H3InChIKey
YGDZCXOSSQEGHX-UHFFFAOYSA-NSynonyms
675856-24-32(((4ethyl5phenyl4H124triazol3yl)sulfanyl)methyl)benzonitrile
2(((4ethyl5phenyl4H124triazol3yl)thio)methyl)benzonitrile
2((4ETHYL5PHENYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
675856243
CCN1C(=NN=C1SCC2=CC=CC=C2C#N)C3=CC=CC=C3
InChI=1SC18H16N4Sc122217(148435914)202118(22)23131611761015(16)1219h311H213H21H3
MFCD04333423
ZINC000000620179
ZINC00620179
ZINC620179
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