Vitas-M small molecule compound
(2E)-3-(4-chlorophenyl)-N-[(2,4-dimethylphenyl)carbamothioyl]prop-2-enamide
Catalog ID
STK141413
SMILES O=C(NC(=S)Nc1ccc(cc1C)C)/C=C/c1ccc(cc1)Cl
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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 C18H17ClN2OS MW 344.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN2OS/c1-12-3-9-16(13(2)11-12)20-18(23)21-17(22)10-6-14-4-7-15(19)8-5-14/h3-11H,1-2H3,(H2,20,21,22,23)/b10-6+InChIKey
MDEYRTUQMGOQNP-UXBLZVDNSA-NSynonyms
(2E)3(4CHLOROPHENYL)N((24DIMETHYLPHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
(E)3(4CHLOROPHENYL)N((24DIMETHYLPHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
CC1=CC(=C(C=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)Cl)C
InChI=1SC18H17ClN2OSc1123916(13(2)1112)2018(23)2117(22)106144715(19)8514h311H12H3(H220212223)b106+
MFCD03030939
O=C(NC(=S)Nc1ccc(cc1C)C)C=Cc1ccc(cc1)Cl
ZINC000004682349
ZINC04682349
ZINC4682349
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