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

Systemtic Name: methyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-5-[(4-fluorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(4-chloro-3-nitro-benzoyl)amino]-5-[(4-fluorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-5-[(4-fluoroanilino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-chloro-3-nitrobenzoyl)amino]-5-[(4-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)amino]-5-[(4-fluorophenyl)carbamoyl]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H15ClFN3O6S MolecularWeight: 491.876703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H15ClFN3O6S/c1-10-16(21(29)32-2)20(25-18(27)11-3-8-14(22)15(9-11)26(30)31)33-17(10)19(28)24-13-6-4-12(23)5-7-13/h3-9H,1-2H3,(H,24,28)(H,25,27)