2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-piperidinosulfonylphenyl)acetamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H27N3O3S/c26-22(17-24-15-12-18-6-2-3-7-19(18)16-24)23-20-8-10-21(11-9-20)29(27,28)25-13-4-1-5-14-25/h2-3,6-11H,1,4-5,12-17H2,(H,23,26)