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

Systemtic Name: ethyl 6-[4-[(3-bromophenyl)carbamoylamino]phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[4-[(3-bromophenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[4-[[(3-bromoanilino)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[(3-bromophenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[4-[(3-bromophenyl)carbamoylamino]phenyl]-2-keto-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H29BrN4O4 MolecularWeight: 577.46896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H29BrN4O4/c1-3-17-34-26(20-9-6-5-7-10-20)24(27(35)38-4-2)25(33-29(34)37)19-13-15-22(16-14-19)31-28(36)32-23-12-8-11-21(30)18-23/h5-16,18,25H,3-4,17H2,1-2H3,(H,33,37)(H2,31,32,36)