N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[2-[(2-methyl-1-piperidyl)methyl]phenyl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[[2-[(2-methyl-1-piperidinyl)methyl]phenyl]methyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: 1-mesyl-N-[2-[(2-methylpiperidino)methyl]benzyl]isonipecotamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC2=CC=CC=C2CNC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC1CCCCN1CC2=CC=CC=C2CNC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C21H33N3O3S/c1-17-7-5-6-12-23(17)16-20-9-4-3-8-19(20)15-22-21(25)18-10-13-24(14-11-18)28(2,26)27/h3-4,8-9,17-18H,5-7,10-16H2,1-2H3,(H,22,25)