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

Systemtic Name: ethyl 5-[[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[1-(4-fluorophenyl)sulfonylpiperidine-4-carbonyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-(4-fluorophenyl)sulfonylpiperidine-4-carbonyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[1-(4-fluorophenyl)sulfonylisonipecotoyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H23FN2O5S2 MolecularWeight: 454.535423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C20H23FN2O5S2/c1-3-28-20(25)18-13(2)12-17(29-18)22-19(24)14-8-10-23(11-9-14)30(26,27)16-6-4-15(21)5-7-16/h4-7,12,14H,3,8-11H2,1-2H3,(H,22,24)