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

Systemtic Name: ethyl 3-butyl-6-[3-[(2,4-dichlorophenyl)carbamoylamino]phenyl]-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-6-[3-[(2,4-dichlorophenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[3-[[(2,4-dichloroanilino)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-6-[3-[(2,4-dichlorophenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[3-[(2,4-dichlorophenyl)carbamoylamino]phenyl]-2-keto-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C30H30Cl2N4O4 MolecularWeight: 581.4896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3=C(C=C(C=C3)Cl)Cl)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)NC3=C(C=C(C=C3)Cl)Cl)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C30H30Cl2N4O4/c1-3-5-16-36-27(19-10-7-6-8-11-19)25(28(37)40-4-2)26(35-30(36)39)20-12-9-13-22(17-20)33-29(38)34-24-15-14-21(31)18-23(24)32/h6-15,17-18,26H,3-5,16H2,1-2H3,(H,35,39)(H2,33,34,38)