N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidyl]-N-(3-pyridylmethyl)acetamide CAS Name: N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidinyl]-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-[1-(2-mesylbenzyl)-4-piperidyl]-N-(3-pyridylmethyl)acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=CN=CC=C1)C2CCN(CC2)CC3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CC(=O)N(CC1=CN=CC=C1)C2CCN(CC2)CC3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C21H27N3O3S/c1-17(25)24(15-18-6-5-11-22-14-18)20-9-12-23(13-10-20)16-19-7-3-4-8-21(19)28(2,26)27/h3-8,11,14,20H,9-10,12-13,15-16H2,1-2H3