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

Systemtic Name: methyl (5S)-7-methyl-2-methylsulfanyl-5-(4-nitrophenyl)-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl (5S)-7-methyl-2-methylsulfanyl-5-(4-nitrophenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5S)-7-methyl-2-(methylthio)-5-(4-nitrophenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl (5S)-7-methyl-2-methylsulfanyl-5-(4-nitrophenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5S)-4-keto-7-methyl-2-(methylthio)-5-(4-nitrophenyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)NC(=NC2=O)SC)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C([C@H](C2=C(N1)NC(=NC2=O)SC)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H16N4O5S/c1-8-11(16(23)26-2)12(9-4-6-10(7-5-9)21(24)25)13-14(18-8)19-17(27-3)20-15(13)22/h4-7,12H,1-3H3,(H2,18,19,20,22)/t12-/m1/s1