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

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1-methylsulfonylpiperidin-4-yl)thiophene-2-carboxamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1-methylsulfonyl-4-piperidyl)thiophene-2-carboxamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1-methylsulfonyl-4-piperidinyl)-2-thiophenecarboxamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1-methylsulfonylpiperidin-4-yl)thiophene-2-carboxamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1-mesyl-4-piperidyl)thiophene-2-carboxamide Formula: C20H25N3O5S3 MolecularWeight: 483.6246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H25N3O5S3/c1-30(25,26)22-11-7-17(8-12-22)21-20(24)19-18(9-13-29-19)31(27,28)23-10-6-15-4-2-3-5-16(15)14-23/h2-5,9,13,17H,6-8,10-12,14H2,1H3,(H,21,24)