methyl 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]thiophene-3-carboxylate CAS Name: 5-[(4-fluoroanilino)-oxomethyl]-4-methyl-2-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-[(4-methyl-3-nitrobenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-[(4-fluorophenyl)carbamoyl]-4-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C22H18FN3O6S MolecularWeight: 471.458223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)NC3=CC=C(C=C3)F)C)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)NC3=CC=C(C=C3)F)C)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H18FN3O6S/c1-11-4-5-13(10-16(11)26(30)31)19(27)25-21-17(22(29)32-3)12(2)18(33-21)20(28)24-15-8-6-14(23)7-9-15/h4-10H,1-3H3,(H,24,28)(H,25,27)