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

Systemtic Name: methyl (5S)-7-methyl-2-(2-methylpropylsulfanyl)-4-oxidanylidene-5-pyridin-3-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl (5S)-2-isobutylsulfanyl-7-methyl-4-oxo-5-(3-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5S)-7-methyl-2-(2-methylpropylthio)-4-oxo-5-(3-pyridinyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl (5S)-7-methyl-2-(2-methylpropylsulfanyl)-4-oxo-5-pyridin-3-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5S)-2-(isobutylthio)-4-keto-7-methyl-5-(3-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)NC(=NC2=O)SCC(C)C)C3=CN=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C([C@H](C2=C(N1)NC(=NC2=O)SCC(C)C)C3=CN=CC=C3)C(=O)OC

InChI

InChI=1S/C19H22N4O3S/c1-10(2)9-27-19-22-16-15(17(24)23-19)14(12-6-5-7-20-8-12)13(11(3)21-16)18(25)26-4/h5-8,10,14H,9H2,1-4H3,(H2,21,22,23,24)/t14-/m1/s1