Vitas-M small molecule compound
4-({[4-ethyl-5-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)benzonitrile
Catalog ID
STK245815
SMILES N#Cc1ccc(cc1)C(=O)CSc1nnc(n1CC)c1ccccc1C
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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 C20H18N4OS MW 362.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4OS/c1-3-24-19(17-7-5-4-6-14(17)2)22-23-20(24)26-13-18(25)16-10-8-15(12-21)9-11-16/h4-11H,3,13H2,1-2H3InChIKey
CHNPFRHAGHOTIS-UHFFFAOYSA-NSynonyms
4(((4ETHYL5(2METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)BENZONITRILE
4(2((4ethyl5(2methylphenyl)124triazol3yl)sulfanyl)acetyl)benzonitrile
4(2(4ETHYL5OTOLYL4H(124)TRIAZOL3YLSULFANYL)ACETYL)BENZONITRILE
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)C3=CC=CC=C3C
InChI=1SC20H18N4OSc132419(17754614(17)2)222320(24)261318(25)1610815(1221)91116h411H313H212H3
MFCD08670559
ZINC000009328154
ZINC09328154
ZINC9328154
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