N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-2-fluoranyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-2-fluoranyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-2-fluoro-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide CAS Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-2-fluoro-N-[2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-2-fluoro-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Traditional Name: N-[1-(3-cyanobenzyl)-4-piperidyl]-2-fluoro-N-(2-pyrrolidinoethyl)benzenesulfonamide Formula: C25H31FN4O2S MolecularWeight: 470.602643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN(C2CCN(CC2)CC3=CC=CC(=C3)C#N)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CCN(C1)CCN(C2CCN(CC2)CC3=CC=CC(=C3)C#N)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H31FN4O2S/c26-24-8-1-2-9-25(24)33(31,32)30(17-16-28-12-3-4-13-28)23-10-14-29(15-11-23)20-22-7-5-6-21(18-22)19-27/h1-2,5-9,18,23H,3-4,10-17,20H2