N-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethanamide

Systemtic Name: N-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethanamide Openeye Name: 2-(4-methyl-1-piperidyl)-2-oxo-N-[2-(p-tolylsulfonyl)-2-(3-pyridyl)ethyl]acetamide CAS Name: N-[2-(4-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-2-(4-methyl-1-piperidinyl)-2-oxoacetamide IUPAC Name: N-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]-2-(4-methylpiperidin-1-yl)-2-oxoacetamide Traditional Name: 2-keto-2-(4-methylpiperidino)-N-[2-(3-pyridyl)-2-tosyl-ethyl]acetamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H27N3O4S/c1-16-5-7-19(8-6-16)30(28,29)20(18-4-3-11-23-14-18)15-24-21(26)22(27)25-12-9-17(2)10-13-25/h3-8,11,14,17,20H,9-10,12-13,15H2,1-2H3,(H,24,26)