Vitas-M small molecule compound
ethyl 4-[(2-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-3-[5-(3-nitrophenyl)furan-2-yl]acryloyl)amino]benzoate
Catalog ID
STK534121
SMILES CCOC(=O)c1ccc(cc1)NC(=O)/C(=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C(=O)Nc1ccc(cc1)C(=O)OCC
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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 C32H27N3O9 MW 597.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27N3O9/c1-3-42-31(38)20-8-12-23(13-9-20)33-29(36)27(30(37)34-24-14-10-21(11-15-24)32(39)43-4-2)19-26-16-17-28(44-26)22-6-5-7-25(18-22)35(40)41/h5-19H,3-4H2,1-2H3,(H,33,36)(H,34,37)InChIKey
GLEYOSPHARCOSY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)NC4=CC=C(C=C4)C(=O)OCC
CCOC(=O)c1ccc(cc1)NC(=O)C(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))C(=O)Nc1ccc(cc1)C(=O)OCC
diethyl44((2((5(3nitrophenyl)furan2yl)methylene)malonyl)bis(azanediyl))dibenzoate
ethyl4((2((4(ethoxycarbonyl)phenyl)carbamoyl)3(5(3nitrophenyl)furan2yl)acryloyl)amino)benzoate
ETHYL4((2((4ETHOXYCARBONYLPHENYL)CARBAMOYL)3(5(3NITROPHENYL)FURAN2YL)PROP2ENOYL)AMINO)BENZOATE
InChI=1SC32H27N3O9c134231(38)2081223(13920)3329(36)27(30(37)3424141021(111524)32(39)4342)1926161728(4426)2265725(1822)35(40)41h519H34H212H3(H3336)(H3437)
MFCD01958350
ZINC000102413893
ZINC102413893
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