Vitas-M small molecule compound
N-(4-{[(2E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]amino}-2-methoxyphenyl)-1-benzofuran-2-carboxamide
Catalog ID
STK135609
SMILES COc1cc(ccc1NC(=O)c1cc2c(o1)cccc2)NC(=O)/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 C25H18ClN3O6 MW 491.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClN3O6/c1-34-22-14-17(27-24(30)11-7-15-6-9-18(26)20(12-15)29(32)33)8-10-19(22)28-25(31)23-13-16-4-2-3-5-21(16)35-23/h2-14H,1H3,(H,27,30)(H,28,31)/b11-7+InChIKey
LPCJGUIBOPREHC-YRNVUSSQSA-NSynonyms
COC1=C(C=CC(=C1)NC(=O)C=CC2=CC(=C(C=C2)Cl)(N+)(=O)(O))NC(=O)C3=CC4=CC=CC=C4O3
COc1cc(ccc1NC(=O)c1cc2c(o1)cccc2)NC(=O)C=Cc1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC25H18ClN3O6c134221417(2724(30)117156918(26)20(1215)29(32)33)81019(22)2825(31)231316423521(16)3523h214H1H3(H2730)(H2831)b117+
MFCD03306959
N(4(((2E)3(4CHLORO3NITROPHENYL)PROP2ENOYL)AMINO)2METHOXYPHENYL)1BENZOFURAN2CARBOXAMIDE
N(4(((E)3(4CHLORO3NITROPHENYL)PROP2ENOYL)AMINO)2METHOXYPHENYL)1BENZOFURAN2CARBOXAMIDE
ZINC000001107079
ZINC01107079
ZINC1107079
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