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

Systemtic Name: 2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[5-isoquinolylsulfonyl(propyl)amino]acetamide CAS Name: 2-[5-isoquinolinylsulfonyl(propyl)amino]-N-prop-2-enylacetamide IUPAC Name: 2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[5-isoquinolylsulfonyl(propyl)amino]acetamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NCC=C)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCN(CC(=O)NCC=C)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C17H21N3O3S/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/h3,5-8,10,12H,1,4,9,11,13H2,2H3,(H,19,21)