Vitas-M small molecule compound
(2E)-N-{[4-(acetylamino)phenyl]carbamothioyl}-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK134323
SMILES CC(=O)Nc1ccc(cc1)NC(=S)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]
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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 C18H16N4O4S MW 384.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O4S/c1-12(23)19-14-6-8-15(9-7-14)20-18(27)21-17(24)10-5-13-3-2-4-16(11-13)22(25)26/h2-11H,1H3,(H,19,23)(H2,20,21,24,27)/b10-5+InChIKey
OTQZBYYULAPJMR-BJMVGYQFSA-NSynonyms
(2E)N(((4(ACETYLAMINO)PHENYL)AMINO)THIOXOMETHYL)3(3NITROPHENYL)PROP2ENAMIDE
(2E)N((4(ACETYLAMINO)PHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N((4ACETAMIDOPHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O)
CC(=O)Nc1ccc(cc1)NC(=S)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC18H16N4O4Sc112(23)19146815(9714)2018(27)2117(24)1051332416(1113)22(25)26h211H1H3(H1923)(H220212427)b105+
MFCD03037509
ZINC000001181354
ZINC01181354
ZINC1181354
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