N-(1-naphthalen-1-ylethyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(1-naphthalen-1-ylethyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-[1-(1-naphthyl)ethyl]-2-[4-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-[1-(1-naphthalenyl)ethyl]-2-[4-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(1-naphthalen-1-ylethyl)-2-[4-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-[1-(1-naphthyl)ethyl]-2-[4-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C29H25F3N2O3S MolecularWeight: 538.58061

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C29H25F3N2O3S/c1-19(25-12-6-10-20-7-4-5-11-26(20)25)33-28(35)27-17-21-8-2-3-9-22(21)18-34(27)38(36,37)24-15-13-23(14-16-24)29(30,31)32/h2-16,19,27H,17-18H2,1H3,(H,33,35)