N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-1-methylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-1-methylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-1-methylsulfonyl-piperidine-2-carboxamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-1-methylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-1-methylsulfonylpiperidine-2-carboxamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-1-mesyl-pipecolinamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1CCCCN1S(=O)(=O)C)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCC(CNC(=O)C1CCCCN1S(=O)(=O)C)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H31N3O3S/c1-3-18(22-13-11-16-8-4-5-9-17(16)15-22)14-21-20(24)19-10-6-7-12-23(19)27(2,25)26/h4-5,8-9,18-19H,3,6-7,10-15H2,1-2H3,(H,21,24)