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

Systemtic Name: ethyl 6-[3-[(4-bromophenyl)carbonylamino]phenyl]-3-butyl-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-[(4-bromobenzoyl)amino]phenyl]-3-butyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[[(4-bromophenyl)-oxomethyl]amino]phenyl]-3-butyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-[(4-bromobenzoyl)amino]phenyl]-3-butyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(4-bromobenzoyl)amino]phenyl]-3-butyl-2-keto-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C30H30BrN3O4 MolecularWeight: 576.4809

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H30BrN3O4/c1-3-5-18-34-27(20-10-7-6-8-11-20)25(29(36)38-4-2)26(33-30(34)37)22-12-9-13-24(19-22)32-28(35)21-14-16-23(31)17-15-21/h6-17,19,26H,3-5,18H2,1-2H3,(H,32,35)(H,33,37)