N-(1,7-diphenylheptan-4-yl)-2-naphthalen-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(1,7-diphenylheptan-4-yl)-2-naphthalen-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(1-naphthylsulfonyl)-N-[4-phenyl-1-(3-phenylpropyl)butyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(1,7-diphenylheptan-4-yl)-2-(1-naphthalenylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(1,7-diphenylheptan-4-yl)-2-naphthalen-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(1-naphthylsulfonyl)-N-[4-phenyl-1-(3-phenylpropyl)butyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C39H40N2O3S MolecularWeight: 616.8115

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC4=CC=CC=C43)C(=O)NC(CCCC5=CC=CC=C5)CCCC6=CC=CC=C6

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC4=CC=CC=C43)C(=O)NC(CCCC5=CC=CC=C5)CCCC6=CC=CC=C6

InChI

InChI=1S/C39H40N2O3S/c42-39(40-35(24-11-18-30-14-3-1-4-15-30)25-12-19-31-16-5-2-6-17-31)37-28-33-21-7-8-22-34(33)29-41(37)45(43,44)38-27-13-23-32-20-9-10-26-36(32)38/h1-10,13-17,20-23,26-27,35,37H,11-12,18-19,24-25,28-29H2,(H,40,42)