1-(4-fluorophenyl)carbonyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorobenzoyl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]isonipecotamide Formula: C22H26FN3O4S2 MolecularWeight: 479.587943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H26FN3O4S2/c23-18-5-3-17(4-6-18)22(28)25-13-9-16(10-14-25)21(27)24-15-19-7-8-20(31-19)32(29,30)26-11-1-2-12-26/h3-8,16H,1-2,9-15H2,(H,24,27)