prop-2-enyl (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: prop-2-enyl (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: allyl (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 prop-2-enyl ester IUPAC Name: prop-2-enyl (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 allyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S/c1-5-10-28-21(27)16-14(4)23-19-18(17(16)15-9-7-8-13(3)12-15)20(26)25-22(24-19)29-11-6-2/h5-9,12,17H,1-2,10-11H2,3-4H3,(H2,23,24,25,26)/t17-/m1/s1