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

Systemtic Name: ethyl 3-[[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[1-(4-fluorophenyl)sulfonylpiperidine-4-carbonyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(4-fluorophenyl)sulfonylpiperidine-4-carbonyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[1-(4-fluorophenyl)sulfonylisonipecotoyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C25H25FN2O5S2 MolecularWeight: 516.604803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H25FN2O5S2/c1-2-33-25(30)23-21(16-22(34-23)17-6-4-3-5-7-17)27-24(29)18-12-14-28(15-13-18)35(31,32)20-10-8-19(26)9-11-20/h3-11,16,18H,2,12-15H2,1H3,(H,27,29)