Vitas-M small molecule compound
2-({[5-(4-aminophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STK122411
SMILES N#Cc1ccccc1CSc1nnc(n1CC)c1ccc(cc1)N
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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 C18H17N5S MW 335.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5S/c1-2-23-17(13-7-9-16(20)10-8-13)21-22-18(23)24-12-15-6-4-3-5-14(15)11-19/h3-10H,2,12,20H2,1H3InChIKey
NSRMFWKWNBNOCR-UHFFFAOYSA-NSynonyms
2(((5(4AMINOPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)METHYL)BENZONITRILE
2((5(4AMINOPHENYL)4ETHYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
CCN1C(=NN=C1SCC2=CC=CC=C2C#N)C3=CC=C(C=C3)N
InChI=1SC18H17N5Sc122317(137916(20)10813)212218(23)241215643514(15)1119h310H21220H21H3
MFCD03864096
ZINC000000359955
ZINC00359955
ZINC359955
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