O4-ethyl O2-methyl 3-methyl-5-[[5-(2-nitrophenyl)furan-2-yl]carbonylcarbamothioylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-methyl 3-methyl-5-[[5-(2-nitrophenyl)furan-2-yl]carbonylcarbamothioylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 3-methyl-5-[[5-(2-nitrophenyl)furan-2-carbonyl]carbamothioylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[[[5-(2-nitrophenyl)-2-furanyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester IUPAC Name: 4-O-ethyl 2-O-methyl 3-methyl-5-[[5-(2-nitrophenyl)furan-2-carbonyl]carbamothioylamino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[5-(2-nitrophenyl)-2-furoyl]thiocarbamoylamino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester Formula: C22H19N3O8S2 MolecularWeight: 517.53156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O8S2/c1-4-32-20(27)16-11(2)17(21(28)31-3)35-19(16)24-22(34)23-18(26)15-10-9-14(33-15)12-7-5-6-8-13(12)25(29)30/h5-10H,4H2,1-3H3,(H2,23,24,26,34)