methyl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-[(5-nitrofuran-2-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-[(5-nitrofuran-2-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-methyl-2-[(5-nitrofuran-2-carbonyl)amino]-5-(o-tolylcarbamoyl)thiophene-3-carboxylate CAS Name: 4-methyl-5-[(2-methylanilino)-oxomethyl]-2-[[(5-nitro-2-furanyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-[(5-nitrofuran-2-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-methyl-2-[(5-nitro-2-furoyl)amino]-5-(o-tolylcarbamoyl)thiophene-3-carboxylic acid methyl ester Formula: C20H17N3O7S MolecularWeight: 443.42988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C20H17N3O7S/c1-10-6-4-5-7-12(10)21-18(25)16-11(2)15(20(26)29-3)19(31-16)22-17(24)13-8-9-14(30-13)23(27)28/h4-9H,1-3H3,(H,21,25)(H,22,24)