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

Systemtic Name: methyl (5R)-2-butylsulfanyl-7-methyl-4-oxidanylidene-5-pyridin-3-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl (5R)-2-butylsulfanyl-7-methyl-4-oxo-5-(3-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5R)-2-(butylthio)-7-methyl-4-oxo-5-(3-pyridinyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl (5R)-2-butylsulfanyl-7-methyl-4-oxo-5-pyridin-3-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5R)-2-(butylthio)-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:

CCCCSC1=NC(=O)C2=C(N1)NC(=C(C2C3=CN=CC=C3)C(=O)OC)C

Isomeric SMILES

CCCCSC1=NC(=O)C2=C(N1)NC(=C([C@@H]2C3=CN=CC=C3)C(=O)OC)C

InChI

InChI=1S/C19H22N4O3S/c1-4-5-9-27-19-22-16-15(17(24)23-19)14(12-7-6-8-20-10-12)13(11(2)21-16)18(25)26-3/h6-8,10,14H,4-5,9H2,1-3H3,(H2,21,22,23,24)/t14-/m0/s1