propan-2-yl (4R)-2-methyl-4-(3-nitrophenyl)-8-oxidanylidene-6-sulfanylidene-1,4-dihydropyrimido[1,2-c]pyrimidine-3-carboxylate

Systemtic Name: propan-2-yl (4R)-2-methyl-4-(3-nitrophenyl)-8-oxidanylidene-6-sulfanylidene-1,4-dihydropyrimido[1,2-c]pyrimidine-3-carboxylate Openeye Name: isopropyl (4R)-2-methyl-4-(3-nitrophenyl)-8-oxo-6-thioxo-1,4-dihydropyrimido[1,2-c]pyrimidine-3-carboxylate CAS Name: (4R)-2-methyl-4-(3-nitrophenyl)-8-oxo-6-sulfanylidene-1,4-dihydropyrimido[1,2-c]pyrimidine-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (4R)-2-methyl-4-(3-nitrophenyl)-8-oxo-6-sulfanylidene-1,4-dihydropyrimido[1,2-c]pyrimidine-3-carboxylate Traditional Name: (4R)-8-keto-2-methyl-4-(3-nitrophenyl)-6-thioxo-1,4-dihydropyrimido[1,2-c]pyrimidine-3-carboxylic acid isopropyl ester Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=CC(=O)NC2=S)N1)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C([C@H](N2C(=CC(=O)NC2=S)N1)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C18H18N4O5S/c1-9(2)27-17(24)15-10(3)19-13-8-14(23)20-18(28)21(13)16(15)11-5-4-6-12(7-11)22(25)26/h4-9,16,19H,1-3H3,(H,20,23,28)/t16-/m1/s1