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

Systemtic Name: ethyl 2-butylsulfanyl-7-methyl-4-oxidanylidene-5-pyridin-4-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-butylsulfanyl-7-methyl-4-oxo-5-(4-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-(butylthio)-7-methyl-4-oxo-5-pyridin-4-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-butylsulfanyl-7-methyl-4-oxo-5-pyridin-4-yl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(butylthio)-4-keto-7-methyl-5-(4-pyridyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O3S/c1-4-6-11-28-20-23-17-16(18(25)24-20)15(13-7-9-21-10-8-13)14(12(3)22-17)19(26)27-5-2/h7-10,15H,4-6,11H2,1-3H3,(H2,22,23,24,25)