ethyl 6-[4-[(4-chloranyl-3-nitro-phenyl)carbonylamino]phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[4-[(4-chloranyl-3-nitro-phenyl)carbonylamino]phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[4-[(4-chloro-3-nitro-benzoyl)amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[4-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[(4-chloro-3-nitrobenzoyl)amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[4-[(4-chloro-3-nitro-benzoyl)amino]phenyl]-2-keto-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H27ClN4O6 MolecularWeight: 563.00088

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C29H27ClN4O6/c1-3-16-33-26(19-8-6-5-7-9-19)24(28(36)40-4-2)25(32-29(33)37)18-10-13-21(14-11-18)31-27(35)20-12-15-22(30)23(17-20)34(38)39/h5-15,17,25H,3-4,16H2,1-2H3,(H,31,35)(H,32,37)