methyl 4-(2,4-dimethylphenyl)-5-methyl-2-[(5-nitrofuran-2-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(2,4-dimethylphenyl)-5-methyl-2-[(5-nitrofuran-2-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(2,4-dimethylphenyl)-5-methyl-2-[(5-nitrofuran-2-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(2,4-dimethylphenyl)-5-methyl-2-[[(5-nitro-2-furanyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2,4-dimethylphenyl)-5-methyl-2-[(5-nitrofuran-2-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(2,4-dimethylphenyl)-5-methyl-2-[(5-nitro-2-furoyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=CC=C(O3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=CC=C(O3)[N+](=O)[O-])C)C

InChI

InChI=1S/C20H18N2O6S/c1-10-5-6-13(11(2)9-10)16-12(3)29-19(17(16)20(24)27-4)21-18(23)14-7-8-15(28-14)22(25)26/h5-9H,1-4H3,(H,21,23)