2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-propyl-ethanamide

Systemtic Name: 2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-propyl-ethanamide Openeye Name: 2-[5-isoquinolylsulfonyl(propyl)amino]-N-propyl-acetamide CAS Name: 2-[5-isoquinolinylsulfonyl(propyl)amino]-N-propylacetamide IUPAC Name: 2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-propylacetamide Traditional Name: 2-[5-isoquinolylsulfonyl(propyl)amino]-N-propyl-acetamide Formula: C17H23N3O3S MolecularWeight: 349.44782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(CCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCNC(=O)CN(CCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C17H23N3O3S/c1-3-9-19-17(21)13-20(11-4-2)24(22,23)16-7-5-6-14-12-18-10-8-15(14)16/h5-8,10,12H,3-4,9,11,13H2,1-2H3,(H,19,21)