N-(5-azanylpentyl)-N-hexyl-isoquinoline-5-sulfonamide

Systemtic Name: N-(5-azanylpentyl)-N-hexyl-isoquinoline-5-sulfonamide Openeye Name: N-(5-aminopentyl)-N-hexyl-isoquinoline-5-sulfonamide CAS Name: N-(5-aminopentyl)-N-hexyl-5-isoquinolinesulfonamide IUPAC Name: N-(5-aminopentyl)-N-hexylisoquinoline-5-sulfonamide Traditional Name: N-(5-aminopentyl)-N-hexyl-isoquinoline-5-sulfonamide Formula: C20H31N3O2S MolecularWeight: 377.54404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCN)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCCCCN(CCCCCN)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C20H31N3O2S/c1-2-3-4-7-15-23(16-8-5-6-13-21)26(24,25)20-11-9-10-18-17-22-14-12-19(18)20/h9-12,14,17H,2-8,13,15-16,21H2,1H3