methyl (5S)-5-(3-methoxyphenyl)-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-methoxyphenyl)-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-methoxyphenyl)-7-methyl-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5S)-5-(3-methoxyphenyl)-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-methoxyphenyl)-7-methyl-4-oxo-2-prop-2-enylsulfanyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5S)-2-(allylthio)-4-keto-5-(3-methoxyphenyl)-7-methyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O4S/c1-5-9-28-20-22-17-16(18(24)23-20)15(12-7-6-8-13(10-12)26-3)14(11(2)21-17)19(25)27-4/h5-8,10,15H,1,9H2,2-4H3,(H2,21,22,23,24)/t15-/m1/s1