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

Systemtic Name: ethyl (5R)-2-butylsulfanyl-5-(4-methoxycarbonylphenyl)-7-methyl-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl (5R)-2-butylsulfanyl-5-(4-methoxycarbonylphenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5R)-2-(butylthio)-5-(4-methoxycarbonylphenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (5R)-2-butylsulfanyl-5-(4-methoxycarbonylphenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5R)-2-(butylthio)-5-(4-carbomethoxyphenyl)-4-keto-7-methyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O5S/c1-5-7-12-32-23-25-19-18(20(27)26-23)17(16(13(3)24-19)22(29)31-6-2)14-8-10-15(11-9-14)21(28)30-4/h8-11,17H,5-7,12H2,1-4H3,(H2,24,25,26,27)/t17-/m0/s1