propan-2-yl (5S)-7-methyl-5-(3-methylphenyl)-4-oxidanylidene-2-prop-2-enylsulfanyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: propan-2-yl (5S)-7-methyl-5-(3-methylphenyl)-4-oxidanylidene-2-prop-2-enylsulfanyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl (5S)-2-allylsulfanyl-7-methyl-5-(m-tolyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5S)-7-methyl-5-(3-methylphenyl)-4-oxo-2-(prop-2-enylthio)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (5S)-7-methyl-5-(3-methylphenyl)-4-oxo-2-prop-2-enylsulfanyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5S)-2-(allylthio)-4-keto-7-methyl-5-(m-tolyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C3=C(NC(=C2C(=O)OC(C)C)C)NC(=NC3=O)SCC=C

Isomeric SMILES

CC1=CC=CC(=C1)[C@H]2C3=C(NC(=C2C(=O)OC(C)C)C)NC(=NC3=O)SCC=C

InChI

InChI=1S/C22H25N3O3S/c1-6-10-29-22-24-19-18(20(26)25-22)17(15-9-7-8-13(4)11-15)16(14(5)23-19)21(27)28-12(2)3/h6-9,11-12,17H,1,10H2,2-5H3,(H2,23,24,25,26)/t17-/m1/s1