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

Systemtic Name: methyl 2-[(3-bromophenyl)carbonylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-bromobenzoyl)amino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-bromobenzoyl)amino]-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[(3-bromobenzoyl)amino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H15BrFNO3S MolecularWeight: 448.305403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)Br)C(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)Br)C(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H15BrFNO3S/c1-11-16(12-6-8-15(22)9-7-12)17(20(25)26-2)19(27-11)23-18(24)13-4-3-5-14(21)10-13/h3-10H,1-2H3,(H,23,24)