2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)-5-[[(E)-2-phenylethenyl]sulfonylamino]benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)-5-[[(E)-2-phenylethenyl]sulfonylamino]benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isobutyl-5-[[(E)-styryl]sulfonylamino]benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)-5-[[(E)-2-phenylethenyl]sulfonylamino]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methylpropyl)-5-[[(E)-2-phenylethenyl]sulfonylamino]benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isobutyl-5-[[(E)-styryl]sulfonylamino]benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C=CC(=C1)NS(=O)(=O)C=CC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NS(=O)(=O)/C=C/C2=CC=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C28H31N3O3S/c1-21(2)19-29-28(32)26-18-25(30-35(33,34)17-15-22-8-4-3-5-9-22)12-13-27(26)31-16-14-23-10-6-7-11-24(23)20-31/h3-13,15,17-18,21,30H,14,16,19-20H2,1-2H3,(H,29,32)/b17-15+