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

Systemtic Name: ethyl (5R)-2-butylsulfanyl-7-methyl-5-(4-methylphenyl)-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl (5R)-2-butylsulfanyl-7-methyl-4-oxo-5-(p-tolyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5R)-2-(butylthio)-7-methyl-5-(4-methylphenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (5R)-2-butylsulfanyl-7-methyl-5-(4-methylphenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5R)-2-(butylthio)-4-keto-7-methyl-5-(p-tolyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S/c1-5-7-12-29-22-24-19-18(20(26)25-22)17(15-10-8-13(3)9-11-15)16(14(4)23-19)21(27)28-6-2/h8-11,17H,5-7,12H2,1-4H3,(H2,23,24,25,26)/t17-/m0/s1