ethyl 2-methylsulfanyl-5-[(5-nitrofuran-2-yl)carbonylamino]-3-(thiophen-2-ylmethyl)imidazole-4-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-5-[(5-nitrofuran-2-yl)carbonylamino]-3-(thiophen-2-ylmethyl)imidazole-4-carboxylate Openeye Name: ethyl 2-methylsulfanyl-5-[(5-nitrofuran-2-carbonyl)amino]-3-(2-thienylmethyl)imidazole-4-carboxylate CAS Name: 2-(methylthio)-5-[[(5-nitro-2-furanyl)-oxomethyl]amino]-3-(thiophen-2-ylmethyl)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-5-[(5-nitrofuran-2-carbonyl)amino]-3-(thiophen-2-ylmethyl)imidazole-4-carboxylate Traditional Name: 2-(methylthio)-5-[(5-nitro-2-furoyl)amino]-3-(2-thenyl)imidazole-4-carboxylic acid ethyl ester Formula: C17H16N4O6S2 MolecularWeight: 436.46214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1CC2=CC=CS2)SC)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1CC2=CC=CS2)SC)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O6S2/c1-3-26-16(23)13-14(18-15(22)11-6-7-12(27-11)21(24)25)19-17(28-2)20(13)9-10-5-4-8-29-10/h4-8H,3,9H2,1-2H3,(H,18,22)