ethyl 3-butyl-4-methyl-6-[3-[(3-nitrophenyl)carbonylamino]phenyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-butyl-4-methyl-6-[3-[(3-nitrophenyl)carbonylamino]phenyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-4-methyl-6-[3-[(3-nitrobenzoyl)amino]phenyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-4-methyl-6-[3-[[(3-nitrophenyl)-oxomethyl]amino]phenyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-4-methyl-6-[3-[(3-nitrobenzoyl)amino]phenyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-2-keto-4-methyl-6-[3-[(3-nitrobenzoyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H28N4O6 MolecularWeight: 480.51302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC)C

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC)C

InChI

InChI=1S/C25H28N4O6/c1-4-6-13-28-16(3)21(24(31)35-5-2)22(27-25(28)32)17-9-7-11-19(14-17)26-23(30)18-10-8-12-20(15-18)29(33)34/h7-12,14-15,22H,4-6,13H2,1-3H3,(H,26,30)(H,27,32)