Vitas-M small molecule compound
(2E)-N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK393574
SMILES O=C(NC(=S)Nc1cc(ccc1Cl)C(F)(F)F)/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 C17H11ClF3N3O3S MW 429.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11ClF3N3O3S/c18-13-6-5-11(17(19,20)21)9-14(13)22-16(28)23-15(25)7-4-10-2-1-3-12(8-10)24(26)27/h1-9H,(H2,22,23,25,28)/b7-4+InChIKey
MQNFUMPWQTWNJH-QPJJXVBHSA-NSynonyms
(2E)N(((2CHLORO5(TRIFLUOROMETHYL)PHENYL)AMINO)THIOXOMETHYL)3(3NITROPHENYL)PROP2ENAMIDE
(2E)N((2chloro5(trifluoromethyl)phenyl)carbamothioyl)3(3nitrophenyl)prop2enamide
(E)N((2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
C1=CC(=CC(=C1)(N+)(=O)(O))C=CC(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl
InChI=1SC17H11ClF3N3O3Sc18136511(17(1920)21)914(13)2216(28)2315(25)741021312(810)24(26)27h19H(H222232528)b74+
MFCD03037517
O=C(NC(=S)Nc1cc(ccc1Cl)C(F)(F)F)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000001181010
ZINC01181010
ZINC1181010
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