Vitas-M small molecule compound
2-chloro-N-[3-({[(2E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioyl}amino)phenyl]benzamide
Catalog ID
STK072118
SMILES S=C(Nc1cccc(c1)NC(=O)c1ccccc1Cl)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 C23H17Cl2N3O2S MW 470.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Cl2N3O2S/c24-16-11-8-15(9-12-16)10-13-21(29)28-23(31)27-18-5-3-4-17(14-18)26-22(30)19-6-1-2-7-20(19)25/h1-14H,(H,26,30)(H2,27,28,29,31)/b13-10+InChIKey
QLVUHMVUYKUUPL-JLHYYAGUSA-NSynonyms
2CHLORON(3((((2E)3(4CHLOROPHENYL)PROP2ENOYL)CARBAMOTHIOYL)AMINO)PHENYL)BENZAMIDE
2CHLORON(3(((E)3(4CHLOROPHENYL)PROP2ENOYL)CARBAMOTHIOYLAMINO)PHENYL)BENZAMIDE
C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C=CC3=CC=C(C=C3)Cl)Cl
InChI=1SC23H17Cl2N3O2Sc241611815(91216)101321(29)2823(31)271853417(1418)2622(30)19612720(19)25h114H(H2630)(H227282931)b1310+
MFCD02923460
S=C(Nc1cccc(c1)NC(=O)c1ccccc1Cl)NC(=O)C=Cc1ccc(cc1)Cl
STK072118
ZINC000002856636
ZINC02856636
ZINC2856636
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