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

Systemtic Name: 2-methylpropyl 7-methyl-5-(3-nitrophenyl)-4-oxidanylidene-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 7-methyl-5-(3-nitrophenyl)-4-oxo-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 7-methyl-5-(3-nitrophenyl)-4-oxo-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 7-methyl-5-(3-nitrophenyl)-4-oxo-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-7-methyl-5-(3-nitrophenyl)-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester Formula: C19H20N4O5S MolecularWeight: 416.4509

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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)OCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O5S/c1-9(2)8-28-18(25)13-10(3)20-16-15(17(24)22-19(29)21-16)14(13)11-5-4-6-12(7-11)23(26)27/h4-7,9,14H,8H2,1-3H3,(H3,20,21,22,24,29)