(4S)-4-(5-bromanyl-2-oxidanyl-phenyl)-6-methyl-N-(4-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4S)-4-(5-bromanyl-2-oxidanyl-phenyl)-6-methyl-N-(4-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4S)-4-(5-bromo-2-hydroxy-phenyl)-6-methyl-2-oxo-N-(p-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4S)-4-(5-bromo-2-hydroxyphenyl)-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4S)-4-(5-bromo-2-hydroxyphenyl)-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4S)-4-(5-bromo-2-hydroxy-phenyl)-2-keto-6-methyl-N-(p-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C19H18BrN3O3 MolecularWeight: 416.26852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(NC(=O)NC2C3=C(C=CC(=C3)Br)O)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(NC(=O)N[C@H]2C3=C(C=CC(=C3)Br)O)C

InChI

InChI=1S/C19H18BrN3O3/c1-10-3-6-13(7-4-10)22-18(25)16-11(2)21-19(26)23-17(16)14-9-12(20)5-8-15(14)24/h3-9,17,24H,1-2H3,(H,22,25)(H2,21,23,26)/t17-/m0/s1