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

Systemtic Name: propan-2-yl (5R)-2-butylsulfanyl-7-methyl-5-(3-methylthiophen-2-yl)-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl (5R)-2-butylsulfanyl-7-methyl-5-(3-methyl-2-thienyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5R)-2-(butylthio)-7-methyl-5-(3-methyl-2-thiophenyl)-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-7-methyl-5-(3-methylthiophen-2-yl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5R)-2-(butylthio)-4-keto-7-methyl-5-(3-methyl-2-thienyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C2=C(N1)NC(=C(C2C3=C(C=CS3)C)C(=O)OC(C)C)C

Isomeric SMILES

CCCCSC1=NC(=O)C2=C(N1)NC(=C([C@@H]2C3=C(C=CS3)C)C(=O)OC(C)C)C

InChI

InChI=1S/C21H27N3O3S2/c1-6-7-9-29-21-23-18-16(19(25)24-21)15(17-12(4)8-10-28-17)14(13(5)22-18)20(26)27-11(2)3/h8,10-11,15H,6-7,9H2,1-5H3,(H2,22,23,24,25)/t15-/m0/s1