propan-2-yl (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: propan-2-yl (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: isopropyl (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 propan-2-yl ester IUPAC Name: propan-2-yl (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 isopropyl ester Formula: C21H26N4O3S MolecularWeight: 414.52114

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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(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3S/c1-11(2)10-29-21-24-18-17(19(26)25-21)16(14-7-6-8-22-9-14)15(13(5)23-18)20(27)28-12(3)4/h6-9,11-12,16H,10H2,1-5H3,(H2,23,24,25,26)/t16-/m1/s1