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

Systemtic Name: ethyl 3-butyl-6-[3-[(4-ethoxycarbonylphenyl)carbamoylamino]phenyl]-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-6-[3-[(4-ethoxycarbonylphenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[3-[[(4-ethoxycarbonylanilino)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-6-[3-[(4-ethoxycarbonylphenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[3-[(4-carbethoxyphenyl)carbamoylamino]phenyl]-2-keto-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C33H36N4O6 MolecularWeight: 584.66214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H36N4O6/c1-4-7-20-37-29(22-12-9-8-10-13-22)27(31(39)43-6-3)28(36-33(37)41)24-14-11-15-26(21-24)35-32(40)34-25-18-16-23(17-19-25)30(38)42-5-2/h8-19,21,28H,4-7,20H2,1-3H3,(H,36,41)(H2,34,35,40)