N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-4-methylsulfonyl-benzamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-4-methylsulfonyl-benzamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-4-methylsulfonylbenzamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-4-methylsulfonylbenzamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-4-mesyl-benzamide Formula: C23H22N2O3S MolecularWeight: 406.49738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2N3CCC4=CC=CC=C4C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H22N2O3S/c1-29(27,28)20-12-10-18(11-13-20)23(26)24-21-8-4-5-9-22(21)25-15-14-17-6-2-3-7-19(17)16-25/h2-13H,14-16H2,1H3,(H,24,26)