N-(2-azanylbutyl)isoquinoline-5-sulfonamide

Systemtic Name: N-(2-azanylbutyl)isoquinoline-5-sulfonamide Openeye Name: N-(2-aminobutyl)isoquinoline-5-sulfonamide CAS Name: N-(2-aminobutyl)-5-isoquinolinesulfonamide IUPAC Name: N-(2-aminobutyl)isoquinoline-5-sulfonamide Traditional Name: N-(2-aminobutyl)isoquinoline-5-sulfonamide Formula: C13H17N3O2S MolecularWeight: 279.35798

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2)N

Isomeric SMILES

CCC(CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2)N

InChI

InChI=1S/C13H17N3O2S/c1-2-11(14)9-16-19(17,18)13-5-3-4-10-8-15-7-6-12(10)13/h3-8,11,16H,2,9,14H2,1H3