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

Systemtic Name: ethyl 6-[3-[(4-tert-butylphenyl)carbonylamino]phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-[(4-tert-butylbenzoyl)amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[[(4-tert-butylphenyl)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-[(4-tert-butylbenzoyl)amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(4-tert-butylbenzoyl)amino]phenyl]-2-keto-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C33H37N3O4 MolecularWeight: 539.66458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H37N3O4/c1-6-20-36-29(22-12-9-8-10-13-22)27(31(38)40-7-2)28(35-32(36)39)24-14-11-15-26(21-24)34-30(37)23-16-18-25(19-17-23)33(3,4)5/h8-19,21,28H,6-7,20H2,1-5H3,(H,34,37)(H,35,39)