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

Systemtic Name: ethyl 6-[4-[(2-bromophenyl)carbamoylamino]phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[4-[(2-bromophenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[4-[[(2-bromoanilino)-oxomethyl]amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[(2-bromophenyl)carbamoylamino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[4-[(2-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=C3Br)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3Br)C(=O)OCC)C4=CC=CC=C4

InChI

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