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

Systemtic Name: ethyl 5-(4-ethoxyphenyl)-2-ethylsulfanyl-7-methyl-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-(4-ethoxyphenyl)-2-ethylsulfanyl-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-(4-ethoxyphenyl)-2-(ethylthio)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-ethoxyphenyl)-2-ethylsulfanyl-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(ethylthio)-4-keto-7-methyl-5-p-phenetyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C3=C(NC(=C2C(=O)OCC)C)NC(=NC3=O)SCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C3=C(NC(=C2C(=O)OCC)C)NC(=NC3=O)SCC

InChI

InChI=1S/C21H25N3O4S/c1-5-27-14-10-8-13(9-11-14)16-15(20(26)28-6-2)12(4)22-18-17(16)19(25)24-21(23-18)29-7-3/h8-11,16H,5-7H2,1-4H3,(H2,22,23,24,25)