N-[4-[1-[3-(4-cyanopyridin-2-yl)propyl]piperidin-4-yl]carbonylphenyl]methanesulfonamide

Systemtic Name: N-[4-[1-[3-(4-cyanopyridin-2-yl)propyl]piperidin-4-yl]carbonylphenyl]methanesulfonamide Openeye Name: N-[4-[1-[3-(4-cyano-2-pyridyl)propyl]piperidine-4-carbonyl]phenyl]methanesulfonamide CAS Name: N-[4-[[1-[3-(4-cyano-2-pyridinyl)propyl]-4-piperidinyl]-oxomethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[1-[3-(4-cyanopyridin-2-yl)propyl]piperidine-4-carbonyl]phenyl]methanesulfonamide Traditional Name: N-[4-[1-[3-(4-cyano-2-pyridyl)propyl]isonipecotoyl]phenyl]methanesulfonamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCCC3=NC=CC(=C3)C#N

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCCC3=NC=CC(=C3)C#N

InChI

InChI=1S/C22H26N4O3S/c1-30(28,29)25-20-6-4-18(5-7-20)22(27)19-9-13-26(14-10-19)12-2-3-21-15-17(16-23)8-11-24-21/h4-8,11,15,19,25H,2-3,9-10,12-14H2,1H3