methyl (5S)-5-(3,4-dimethoxyphenyl)-7-methyl-4-oxidanylidene-2-prop-2-enylsulfanyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl (5S)-5-(3,4-dimethoxyphenyl)-7-methyl-4-oxidanylidene-2-prop-2-enylsulfanyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl (5S)-2-allylsulfanyl-5-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5S)-5-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-2-(prop-2-enylthio)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl (5S)-5-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-2-prop-2-enylsulfanyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5S)-2-(allylthio)-5-(3,4-dimethoxyphenyl)-4-keto-7-methyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)NC(=NC2=O)SCC=C)C3=CC(=C(C=C3)OC)OC)C(=O)OC

Isomeric SMILES

CC1=C([C@H](C2=C(N1)NC(=NC2=O)SCC=C)C3=CC(=C(C=C3)OC)OC)C(=O)OC

InChI

InChI=1S/C21H23N3O5S/c1-6-9-30-21-23-18-17(19(25)24-21)16(15(11(2)22-18)20(26)29-5)12-7-8-13(27-3)14(10-12)28-4/h6-8,10,16H,1,9H2,2-5H3,(H2,22,23,24,25)/t16-/m1/s1