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

Systemtic Name: (4S)-4-(5-bromanyl-2-prop-2-enoxy-phenyl)-6-methyl-N-(3-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4S)-4-(2-allyloxy-5-bromo-phenyl)-6-methyl-N-(m-tolyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4S)-4-(5-bromo-2-prop-2-enoxyphenyl)-6-methyl-N-(3-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4S)-4-(5-bromo-2-prop-2-enoxyphenyl)-6-methyl-N-(3-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4S)-4-(2-allyloxy-5-bromo-phenyl)-2-keto-6-methyl-N-(m-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrN3O3/c1-4-10-29-18-9-8-15(23)12-17(18)20-19(14(3)24-22(28)26-20)21(27)25-16-7-5-6-13(2)11-16/h4-9,11-12,20H,1,10H2,2-3H3,(H,25,27)(H2,24,26,28)/t20-/m0/s1