N-(3-chloranyl-4-fluoranyl-phenyl)-2-naphthalen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-naphthalen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-(2-naphthylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-(2-naphthalenylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-naphthalen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-(2-naphthylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C26H20ClFN2O3S MolecularWeight: 494.965003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=O)NC5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=O)NC5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C26H20ClFN2O3S/c27-23-15-21(10-12-24(23)28)29-26(31)25-14-19-7-3-4-8-20(19)16-30(25)34(32,33)22-11-9-17-5-1-2-6-18(17)13-22/h1-13,15,25H,14,16H2,(H,29,31)