1-(4-fluorophenyl)carbonyl-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorobenzoyl)-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-(2-methyl-5-piperidinosulfonyl-phenyl)isonipecotamide Formula: C25H30FN3O4S MolecularWeight: 487.586803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H30FN3O4S/c1-18-5-10-22(34(32,33)29-13-3-2-4-14-29)17-23(18)27-24(30)19-11-15-28(16-12-19)25(31)20-6-8-21(26)9-7-20/h5-10,17,19H,2-4,11-16H2,1H3,(H,27,30)