(4S)-N-(4-bromophenyl)-6-methyl-2-oxidanylidene-4-(3-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4S)-N-(4-bromophenyl)-6-methyl-2-oxidanylidene-4-(3-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4S)-4-(3-benzyloxyphenyl)-N-(4-bromophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4S)-N-(4-bromophenyl)-6-methyl-2-oxo-4-(3-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4S)-N-(4-bromophenyl)-6-methyl-2-oxo-4-(3-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4S)-4-(3-benzoxyphenyl)-N-(4-bromophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C25H22BrN3O3 MolecularWeight: 492.36448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC(=CC=C2)OCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1)C2=CC(=CC=C2)OCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C25H22BrN3O3/c1-16-22(24(30)28-20-12-10-19(26)11-13-20)23(29-25(31)27-16)18-8-5-9-21(14-18)32-15-17-6-3-2-4-7-17/h2-14,23H,15H2,1H3,(H,28,30)(H2,27,29,31)/t23-/m0/s1