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

Systemtic Name: diethyl 3-methyl-5-[[5-(2-nitrophenyl)furan-2-yl]carbonylcarbamothioylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 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 diethyl ester IUPAC Name: diethyl 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 diethyl ester Formula: C23H21N3O8S2 MolecularWeight: 531.55814

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C23H21N3O8S2/c1-4-32-21(28)17-12(3)18(22(29)33-5-2)36-20(17)25-23(35)24-19(27)16-11-10-15(34-16)13-8-6-7-9-14(13)26(30)31/h6-11H,4-5H2,1-3H3,(H2,24,25,27,35)