Vitas-M small molecule compound
methyl 4-{(1E)-2-cyano-3-[(2-methyl-4-nitrophenyl)amino]-3-oxoprop-1-en-1-yl}benzoate
Catalog ID
STL383569
SMILES N#C/C(=C\c1ccc(cc1)C(=O)OC)/C(=O)Nc1ccc(cc1C)[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 C19H15N3O5 MW 365.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O5/c1-12-9-16(22(25)26)7-8-17(12)21-18(23)15(11-20)10-13-3-5-14(6-4-13)19(24)27-2/h3-10H,1-2H3,(H,21,23)/b15-10+InChIKey
HTTXVAMTCOEEOD-XNTDXEJSSA-NSynonyms
CC1=C(C=CC(=C1)(N+)(=O)(O))NC(=O)C(=CC2=CC=C(C=C2)C(=O)OC)C#N
InChI=1SC19H15N3O5c112916(22(25)26)7817(12)2118(23)15(1120)10133514(6413)19(24)272h310H12H3(H2123)b1510+
METHYL4((1E)2CYANO2(N(2METHYL4NITROPHENYL)CARBAMOYL)VINYL)BENZOATE
methyl4((1E)2cyano3((2methyl4nitrophenyl)amino)3oxoprop1en1yl)benzoate
METHYL4((E)2CYANO3(2METHYL4NITROANILINO)3OXOPROP1ENYL)BENZOATE
MFCD02225267
N#CC(=Cc1ccc(cc1)C(=O)OC)C(=O)Nc1ccc(cc1C)(N+)(=O)(O)
ZINC000004953819
ZINC04953819
ZINC4953819
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