N-[2-(hexylamino)propyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[2-(hexylamino)propyl]isoquinoline-5-sulfonamide Openeye Name: N-[2-(hexylamino)propyl]isoquinoline-5-sulfonamide CAS Name: N-[2-(hexylamino)propyl]-5-isoquinolinesulfonamide IUPAC Name: N-[2-(hexylamino)propyl]isoquinoline-5-sulfonamide Traditional Name: N-[2-(hexylamino)propyl]isoquinoline-5-sulfonamide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(C)CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCCCCNC(C)CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C18H27N3O2S/c1-3-4-5-6-11-20-15(2)13-21-24(22,23)18-9-7-8-16-14-19-12-10-17(16)18/h7-10,12,14-15,20-21H,3-6,11,13H2,1-2H3