1-(4-fluorophenyl)carbonyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)piperidine-3-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]piperidine-3-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-fluorobenzoyl)-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)piperidine-3-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-(4-methyl-3-piperidinosulfonyl-phenyl)nipecotamide Formula: C25H30FN3O4S MolecularWeight: 487.586803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H30FN3O4S/c1-18-7-12-22(16-23(18)34(32,33)29-14-3-2-4-15-29)27-24(30)20-6-5-13-28(17-20)25(31)19-8-10-21(26)11-9-19/h7-12,16,20H,2-6,13-15,17H2,1H3,(H,27,30)