N-hexyl-N-[2-(hexylamino)ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-hexyl-N-[2-(hexylamino)ethyl]isoquinoline-5-sulfonamide Openeye Name: N-hexyl-N-[2-(hexylamino)ethyl]isoquinoline-5-sulfonamide CAS Name: N-hexyl-N-[2-(hexylamino)ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-hexyl-N-[2-(hexylamino)ethyl]isoquinoline-5-sulfonamide Traditional Name: N-hexyl-N-[2-(hexylamino)ethyl]isoquinoline-5-sulfonamide Formula: C23H37N3O2S MolecularWeight: 419.62378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCCN(CCCCCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCCCCNCCN(CCCCCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C23H37N3O2S/c1-3-5-7-9-15-24-17-19-26(18-10-8-6-4-2)29(27,28)23-13-11-12-21-20-25-16-14-22(21)23/h11-14,16,20,24H,3-10,15,17-19H2,1-2H3