4-propyl-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide

Systemtic Name: 4-propyl-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide Openeye Name: 4-propyl-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]benzenesulfonamide CAS Name: 4-propyl-N-[[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]benzenesulfonamide IUPAC Name: 4-propyl-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide Traditional Name: 4-propyl-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]benzenesulfonamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NCC2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NCC2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C21H29N3O2S/c1-2-3-18-4-6-21(7-5-18)27(25,26)23-16-19-10-14-24(15-11-19)17-20-8-12-22-13-9-20/h4-9,12-13,19,23H,2-3,10-11,14-17H2,1H3