N-[1-(4-cyanophenyl)ethyl]-1-methylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[1-(4-cyanophenyl)ethyl]-1-methylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[1-(4-cyanophenyl)ethyl]-1-methylsulfonyl-piperidine-2-carboxamide CAS Name: N-[1-(4-cyanophenyl)ethyl]-1-methylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[1-(4-cyanophenyl)ethyl]-1-methylsulfonylpiperidine-2-carboxamide Traditional Name: N-[1-(4-cyanophenyl)ethyl]-1-mesyl-pipecolinamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)NC(=O)C2CCCCN2S(=O)(=O)C

Isomeric SMILES

CC(C1=CC=C(C=C1)C#N)NC(=O)C2CCCCN2S(=O)(=O)C

InChI

InChI=1S/C16H21N3O3S/c1-12(14-8-6-13(11-17)7-9-14)18-16(20)15-5-3-4-10-19(15)23(2,21)22/h6-9,12,15H,3-5,10H2,1-2H3,(H,18,20)