ethyl 6-[3-[(3-chlorophenyl)carbamoylamino]phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[3-[(3-chlorophenyl)carbamoylamino]phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-[(3-chlorophenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[[(3-chloroanilino)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-[(3-chlorophenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(3-chlorophenyl)carbamoylamino]phenyl]-2-keto-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H29ClN4O4 MolecularWeight: 533.01796

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3=CC(=CC=C3)Cl)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3=CC(=CC=C3)Cl)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C29H29ClN4O4/c1-3-16-34-26(19-10-6-5-7-11-19)24(27(35)38-4-2)25(33-29(34)37)20-12-8-14-22(17-20)31-28(36)32-23-15-9-13-21(30)18-23/h5-15,17-18,25H,3-4,16H2,1-2H3,(H,33,37)(H2,31,32,36)