propan-2-yl 6-[3-[(4-bromophenyl)carbonylamino]phenyl]-4-methyl-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 6-[3-[(4-bromophenyl)carbonylamino]phenyl]-4-methyl-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 6-[3-[(4-bromobenzoyl)amino]phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[[(4-bromophenyl)-oxomethyl]amino]phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 6-[3-[(4-bromobenzoyl)amino]phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(4-bromobenzoyl)amino]phenyl]-2-keto-4-methyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C25H28BrN3O4 MolecularWeight: 514.41152

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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)Br)C(=O)OC(C)C)C

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)Br)C(=O)OC(C)C)C

InChI

InChI=1S/C25H28BrN3O4/c1-5-13-29-16(4)21(24(31)33-15(2)3)22(28-25(29)32)18-7-6-8-20(14-18)27-23(30)17-9-11-19(26)12-10-17/h6-12,14-15,22H,5,13H2,1-4H3,(H,27,30)(H,28,32)