methyl 3-[[1-(4-fluorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[[1-(4-fluorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: methyl 3-[[1-(4-fluorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[[1-(4-fluorophenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[1-(4-fluorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[1-(4-fluorophenyl)sulfonylprolyl]amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C23H21FN2O5S2 MolecularWeight: 488.551643

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H21FN2O5S2/c1-31-23(28)21-18(14-20(32-21)15-6-3-2-4-7-15)25-22(27)19-8-5-13-26(19)33(29,30)17-11-9-16(24)10-12-17/h2-4,6-7,9-12,14,19H,5,8,13H2,1H3,(H,25,27)