N-(1-azanylbutan-2-yl)isoquinoline-5-sulfonamide

Systemtic Name: N-(1-azanylbutan-2-yl)isoquinoline-5-sulfonamide Openeye Name: N-[1-(aminomethyl)propyl]isoquinoline-5-sulfonamide CAS Name: N-(1-aminobutan-2-yl)-5-isoquinolinesulfonamide IUPAC Name: N-(1-aminobutan-2-yl)isoquinoline-5-sulfonamide Traditional Name: N-[1-(aminomethyl)propyl]isoquinoline-5-sulfonamide Formula: C13H17N3O2S MolecularWeight: 279.35798

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN)NS(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCC(CN)NS(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

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