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

Systemtic Name: propan-2-yl (5R)-2-butylsulfanyl-5-(3-fluorophenyl)-7-methyl-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl (5R)-2-butylsulfanyl-5-(3-fluorophenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5R)-2-(butylthio)-5-(3-fluorophenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (5R)-2-butylsulfanyl-5-(3-fluorophenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5R)-2-(butylthio)-5-(3-fluorophenyl)-4-keto-7-methyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C22H26FN3O3S MolecularWeight: 431.523543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26FN3O3S/c1-5-6-10-30-22-25-19-18(20(27)26-22)17(14-8-7-9-15(23)11-14)16(13(4)24-19)21(28)29-12(2)3/h7-9,11-12,17H,5-6,10H2,1-4H3,(H2,24,25,26,27)/t17-/m0/s1