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

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-phenoxyethyl)thiophene-2-carboxamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-phenoxyethyl)thiophene-2-carboxamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-phenoxyethyl)-2-thiophenecarboxamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-phenoxyethyl)thiophene-2-carboxamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-phenoxyethyl)thiophene-2-carboxamide Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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)NCCOC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(SC=C3)C(=O)NCCOC4=CC=CC=C4

InChI

InChI=1S/C22H22N2O4S2/c25-22(23-12-14-28-19-8-2-1-3-9-19)21-20(11-15-29-21)30(26,27)24-13-10-17-6-4-5-7-18(17)16-24/h1-9,11,15H,10,12-14,16H2,(H,23,25)