1-(2,5-dimethylphenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]methanesulfonamide

Systemtic Name: 1-(2,5-dimethylphenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]methanesulfonamide Openeye Name: 1-(2,5-dimethylphenyl)-N-[[1-(3-pyridylmethyl)-4-piperidyl]methyl]methanesulfonamide CAS Name: 1-(2,5-dimethylphenyl)-N-[[1-(3-pyridinylmethyl)-4-piperidinyl]methyl]methanesulfonamide IUPAC Name: 1-(2,5-dimethylphenyl)-N-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]methanesulfonamide Traditional Name: 1-(2,5-dimethylphenyl)-N-[[1-(3-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=CN=CC=C3

Isomeric SMILES

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

InChI

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