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

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1-piperidin-1-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1-(1-piperidylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1-(1-piperidinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1-piperidinosulfonyl-isonipecotamide Formula: C22H34N4O3S MolecularWeight: 434.59536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)N2CCC(CC2)C(=O)NCCN3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)N2CCC(CC2)C(=O)NCCN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H34N4O3S/c27-22(23-11-17-24-14-8-19-6-2-3-7-21(19)18-24)20-9-15-26(16-10-20)30(28,29)25-12-4-1-5-13-25/h2-3,6-7,20H,1,4-5,8-18H2,(H,23,27)