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

Systemtic Name: 3-methyl-4-propoxy-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide Openeye Name: 3-methyl-4-propoxy-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]benzenesulfonamide CAS Name: 3-methyl-4-propoxy-N-[[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]benzenesulfonamide IUPAC Name: 3-methyl-4-propoxy-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzenesulfonamide Traditional Name: 3-methyl-4-propoxy-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]benzenesulfonamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)NCC2CCN(CC2)CC3=CC=NC=C3)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)NCC2CCN(CC2)CC3=CC=NC=C3)C

InChI

InChI=1S/C22H31N3O3S/c1-3-14-28-22-5-4-21(15-18(22)2)29(26,27)24-16-19-8-12-25(13-9-19)17-20-6-10-23-11-7-20/h4-7,10-11,15,19,24H,3,8-9,12-14,16-17H2,1-2H3