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

Systemtic Name: 2-methoxyethyl 7-methyl-2-methylsulfanyl-5-(3-nitrophenyl)-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate; methyl 7-methyl-2-methylsulfanyl-5-(3-nitrophenyl)-4-oxidanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-methoxyethyl 7-methyl-2-methylsulfanyl-5-(3-nitrophenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate; methyl 7-methyl-2-methylsulfanyl-5-(3-nitrophenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 7-methyl-2-(methylthio)-5-(3-nitrophenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid 2-methoxyethyl ester; 7-methyl-2-(methylthio)-5-(3-nitrophenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: 2-methoxyethyl 7-methyl-2-methylsulfanyl-5-(3-nitrophenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate; methyl 7-methyl-2-methylsulfanyl-5-(3-nitrophenyl)-4-oxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-7-methyl-2-(methylthio)-5-(3-nitrophenyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid 2-methoxyethyl ester; 4-keto-7-methyl-2-(methylthio)-5-(3-nitrophenyl)-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C36H36N8O11S2 MolecularWeight: 820.84804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O6S.C17H16N4O5S/c1-10-13(18(25)29-8-7-28-2)14(11-5-4-6-12(9-11)23(26)27)15-16(20-10)21-19(30-3)22-17(15)24;1-8-11(16(23)26-2)12(9-5-4-6-10(7-9)21(24)25)13-14(18-8)19-17(27-3)20-15(13)22/h4-6,9,14H,7-8H2,1-3H3,(H2,20,21,22,24);4-7,12H,1-3H3,(H2,18,19,20,22)