ethyl 7-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 7-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-benzylsulfanyl-7-methyl-4-oxo-5-(2-thienyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 7-methyl-4-oxo-2-(phenylmethylthio)-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-7-methyl-4-oxo-5-thiophen-2-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(benzylthio)-4-keto-7-methyl-5-(2-thienyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC=CS3)C(=O)N=C(N2)SCC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC=CS3)C(=O)N=C(N2)SCC4=CC=CC=C4)C

InChI

InChI=1S/C22H21N3O3S2/c1-3-28-21(27)16-13(2)23-19-18(17(16)15-10-7-11-29-15)20(26)25-22(24-19)30-12-14-8-5-4-6-9-14/h4-11,17H,3,12H2,1-2H3,(H2,23,24,25,26)