Vitas-M small molecule compound
(2E)-3-(3-nitrophenyl)-N-[(2,4,5-trichlorophenyl)carbamothioyl]prop-2-enamide
Catalog ID
STK148471
SMILES O=C(NC(=S)Nc1cc(Cl)c(cc1Cl)Cl)/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 C16H10Cl3N3O3S MW 430.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10Cl3N3O3S/c17-11-7-13(19)14(8-12(11)18)20-16(26)21-15(23)5-4-9-2-1-3-10(6-9)22(24)25/h1-8H,(H2,20,21,23,26)/b5-4+InChIKey
KOVXOLHTCWBWPQ-SNAWJCMRSA-NSynonyms
(2E)3(3NITROPHENYL)N((245TRICHLOROPHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
(E)3(3NITROPHENYL)N((245TRICHLOROPHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
C1=CC(=CC(=C1)(N+)(=O)(O))C=CC(=O)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl
InChI=1SC16H10Cl3N3O3Sc1711713(19)14(812(11)18)2016(26)2115(23)54921310(69)22(24)25h18H(H220212326)b54+
MFCD03137758
O=C(NC(=S)Nc1cc(Cl)c(cc1Cl)Cl)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000002828292
ZINC02828292
ZINC2828292
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