methyl 4-(4-fluorophenyl)-5-methyl-2-[(3-nitrophenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-fluorophenyl)-5-methyl-2-[(3-nitrophenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-fluorophenyl)-5-methyl-2-[(3-nitrobenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-5-methyl-2-[[(3-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-fluorophenyl)-5-methyl-2-[(3-nitrobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-5-methyl-2-[(3-nitrobenzoyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C20H15FN2O5S MolecularWeight: 414.406903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H15FN2O5S/c1-11-16(12-6-8-14(21)9-7-12)17(20(25)28-2)19(29-11)22-18(24)13-4-3-5-15(10-13)23(26)27/h3-10H,1-2H3,(H,22,24)