3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-fluoro-4-methoxy-phenyl)methyl]-N-methyl-benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methylbenzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methylbenzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(3-fluoro-4-methoxy-benzyl)-N-methyl-benzamide Formula: C25H25FN2O4S MolecularWeight: 468.540403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H25FN2O4S/c1-27(16-18-10-11-24(32-2)23(26)14-18)25(29)20-8-5-9-22(15-20)33(30,31)28-13-12-19-6-3-4-7-21(19)17-28/h3-11,14-15H,12-13,16-17H2,1-2H3