1-(4-cyanophenyl)sulfonyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]piperidine-4-carboxamide CAS Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]isonipecotamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCN2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NCCN2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H28N4O3S/c25-17-19-5-7-23(8-6-19)32(30,31)28-14-10-21(11-15-28)24(29)26-12-16-27-13-9-20-3-1-2-4-22(20)18-27/h1-8,21H,9-16,18H2,(H,26,29)