N-[(2-cyclopentyloxypyridin-3-yl)methyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-[(2-cyclopentyloxypyridin-3-yl)methyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-[[2-(cyclopentoxy)-3-pyridyl]methyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-[(2-cyclopentyloxypyridin-3-yl)methyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-[[2-(cyclopentoxy)-3-pyridyl]methyl]-2-esyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NCC3=C(N=CC=C3)OC4CCCC4

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NCC3=C(N=CC=C3)OC4CCCC4

InChI

InChI=1S/C23H29N3O4S/c1-2-31(28,29)26-16-19-9-4-3-8-17(19)14-21(26)22(27)25-15-18-10-7-13-24-23(18)30-20-11-5-6-12-20/h3-4,7-10,13,20-21H,2,5-6,11-12,14-16H2,1H3,(H,25,27)