Vitas-M small molecule compound
(2E)-N-(4-bromo-3-methylphenyl)-3-(4-chloro-3-nitrophenyl)prop-2-enamide
Catalog ID
STK209412
SMILES O=C(Nc1ccc(c(c1)C)Br)/C=C/c1ccc(c(c1)[N+](=O)[O-])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 C16H12BrClN2O3 MW 395.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrClN2O3/c1-10-8-12(4-5-13(10)17)19-16(21)7-3-11-2-6-14(18)15(9-11)20(22)23/h2-9H,1H3,(H,19,21)/b7-3+InChIKey
XWTUAMNHOLLBPR-XVNBXDOJSA-NSynonyms
331461-64-4(2E)N(4BROMO3METHYLPHENYL)3(4CHLORO3NITROPHENYL)PROP2ENAMIDE
(E)N(4BROMO3METHYLPHENYL)3(4CHLORO3NITROPHENYL)2PROPENAMIDE
(E)N(4BROMO3METHYLPHENYL)3(4CHLORO3NITROPHENYL)PROP2ENAMIDE
331461644
CC1=C(C=CC(=C1)NC(=O)C=CC2=CC(=C(C=C2)Cl)(N+)(=O)(O))Br
InChI=1SC16H12BrClN2O3c110812(4513(10)17)1916(21)73112614(18)15(911)20(22)23h29H1H3(H1921)b73+
MFCD00169702
O=C(Nc1ccc(c(c1)C)Br)C=Cc1ccc(c(c1)(N+)(=O)(O))Cl
ZINC000001137075
ZINC01137075
ZINC1137075
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