Vitas-M small molecule compound
N-[4-({[(2E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioyl}amino)phenyl]thiophene-2-carboxamide
Catalog ID
STK390428
SMILES S=C(Nc1ccc(cc1)NC(=O)c1cccs1)NC(=O)/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 C21H16ClN3O2S2 MW 441.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O2S2/c22-15-6-3-14(4-7-15)5-12-19(26)25-21(28)24-17-10-8-16(9-11-17)23-20(27)18-2-1-13-29-18/h1-13H,(H,23,27)(H2,24,25,26,28)/b12-5+InChIKey
KJGAZSBMMFZJSX-LFYBBSHMSA-NSynonyms
C1=CSC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=C(C=C3)Cl
InChI=1SC21H16ClN3O2S2c22156314(4715)51219(26)2521(28)241710816(91117)2320(27)1821132918h113H(H2327)(H224252628)b125+
MFCD02922890
N(4((((2E)3(4CHLOROPHENYL)PROP2ENOYL)CARBAMOTHIOYL)AMINO)PHENYL)THIOPHENE2CARBOXAMIDE
N(4(((E)3(4CHLOROPHENYL)PROP2ENOYL)CARBAMOTHIOYLAMINO)PHENYL)THIOPHENE2CARBOXAMIDE
S=C(Nc1ccc(cc1)NC(=O)c1cccs1)NC(=O)C=Cc1ccc(cc1)Cl
ZINC000001180721
ZINC01180721
ZINC1180721
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