3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(phenylmethyl)thiophene-2-carboxamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(phenylmethyl)thiophene-2-carboxamide Openeye Name: N-benzyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(phenylmethyl)-2-thiophenecarboxamide IUPAC Name: N-benzyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide Traditional Name: N-benzyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide Formula: C21H20N2O3S2 MolecularWeight: 412.5251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(SC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(SC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C21H20N2O3S2/c24-21(22-14-16-6-2-1-3-7-16)20-19(11-13-27-20)28(25,26)23-12-10-17-8-4-5-9-18(17)15-23/h1-9,11,13H,10,12,14-15H2,(H,22,24)