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

Systemtic Name: 2-methoxyethyl (5S)-7-methyl-5-(3-nitrophenyl)-4-oxidanylidene-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-methoxyethyl (5S)-7-methyl-5-(3-nitrophenyl)-4-oxo-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: (5S)-7-methyl-5-(3-nitrophenyl)-4-oxo-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (5S)-7-methyl-5-(3-nitrophenyl)-4-oxo-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: (5S)-4-keto-7-methyl-5-(3-nitrophenyl)-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid 2-methoxyethyl ester Formula: C18H18N4O6S MolecularWeight: 418.42372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O6S/c1-9-12(17(24)28-7-6-27-2)13(10-4-3-5-11(8-10)22(25)26)14-15(19-9)20-18(29)21-16(14)23/h3-5,8,13H,6-7H2,1-2H3,(H3,19,20,21,23,29)/t13-/m1/s1