methyl 3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-[[3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-nitro-thiophen-2-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-[[3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-nitro-thiophen-2-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-(2,4-dioxopyrimidin-1-yl)-5-[[3-(2,4-dioxopyrimidin-1-yl)-5-nitro-thiophene-2-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-(2,4-dioxo-1-pyrimidinyl)-5-[[[3-(2,4-dioxo-1-pyrimidinyl)-5-nitro-2-thiophenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(2,4-dioxopyrimidin-1-yl)-5-[[3-(2,4-dioxopyrimidin-1-yl)-5-nitrothiophene-2-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 3-(2,4-diketopyrimidin-1-yl)-5-[[3-(2,4-diketopyrimidin-1-yl)-5-nitro-thiophene-2-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C19H12N6O9S2 MolecularWeight: 532.46338

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(S1)NC(=O)C2=C(C=C(S2)[N+](=O)[O-])N3C=CC(=O)NC3=O)N4C=CC(=O)NC4=O

Isomeric SMILES

COC(=O)C1=C(C=C(S1)NC(=O)C2=C(C=C(S2)[N+](=O)[O-])N3C=CC(=O)NC3=O)N4C=CC(=O)NC4=O

InChI

InChI=1S/C19H12N6O9S2/c1-34-17(29)15-8(23-4-2-10(26)20-18(23)30)6-12(35-15)22-16(28)14-9(7-13(36-14)25(32)33)24-5-3-11(27)21-19(24)31/h2-7H,1H3,(H,22,28)(H,20,26,30)(H,21,27,31)