1-(2,5-dimethylphenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]methanesulfonamide

Systemtic Name: 1-(2,5-dimethylphenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]methanesulfonamide Openeye Name: 1-(2,5-dimethylphenyl)-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]methanesulfonamide CAS Name: 1-(2,5-dimethylphenyl)-N-[[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]methanesulfonamide IUPAC Name: 1-(2,5-dimethylphenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]methanesulfonamide Traditional Name: 1-(2,5-dimethylphenyl)-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]methanesulfonamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CS(=O)(=O)NCC2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CS(=O)(=O)NCC2CCN(CC2)CC3=CC=NC=C3

InChI

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