4-propyl-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide

Systemtic Name: 4-propyl-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide Openeye Name: 4-propyl-N-[[1-(3-pyridylmethyl)-4-piperidyl]methyl]benzenesulfonamide CAS Name: 4-propyl-N-[[1-(3-pyridinylmethyl)-4-piperidinyl]methyl]benzenesulfonamide IUPAC Name: 4-propyl-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide Traditional Name: 4-propyl-N-[[1-(3-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=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O2S/c1-2-4-18-6-8-21(9-7-18)27(25,26)23-16-19-10-13-24(14-11-19)17-20-5-3-12-22-15-20/h3,5-9,12,15,19,23H,2,4,10-11,13-14,16-17H2,1H3