ethyl 4-(2-methylpropyl)-2-[(5-nitrofuran-2-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-methylpropyl)-2-[(5-nitrofuran-2-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-isobutyl-2-[(5-nitrofuran-2-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(2-methylpropyl)-2-[[(5-nitro-2-furanyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methylpropyl)-2-[(5-nitrofuran-2-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-isobutyl-2-[(5-nitro-2-furoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C16H18N2O6S MolecularWeight: 366.38892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)C2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O6S/c1-4-23-16(20)13-10(7-9(2)3)8-25-15(13)17-14(19)11-5-6-12(24-11)18(21)22/h5-6,8-9H,4,7H2,1-3H3,(H,17,19)