Vitas-M small molecule compound
(2E)-N-[(2,5-dichlorophenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK141891
SMILES S=C(Nc1cc(Cl)ccc1Cl)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 C16H11Cl2N3O3S MW 396.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11Cl2N3O3S/c17-11-5-6-13(18)14(9-11)19-16(25)20-15(22)7-4-10-2-1-3-12(8-10)21(23)24/h1-9H,(H2,19,20,22,25)/b7-4+InChIKey
GVSVXEBTMCJSPB-QPJJXVBHSA-NSynonyms
(2E)N((25DICHLOROPHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N((25DICHLOROPHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
C1=CC(=CC(=C1)(N+)(=O)(O))C=CC(=O)NC(=S)NC2=C(C=CC(=C2)Cl)Cl
InChI=1SC16H11Cl2N3O3Sc17115613(18)14(911)1916(25)2015(22)741021312(810)21(23)24h19H(H219202225)b74+
MFCD03137843
S=C(Nc1cc(Cl)ccc1Cl)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000001179834
ZINC01179834
ZINC1179834
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