N-[1-(diethylamino)propan-2-yl]-N-hexyl-isoquinoline-5-sulfonamide

Systemtic Name: N-[1-(diethylamino)propan-2-yl]-N-hexyl-isoquinoline-5-sulfonamide Openeye Name: N-[2-(diethylamino)-1-methyl-ethyl]-N-hexyl-isoquinoline-5-sulfonamide CAS Name: N-[1-(diethylamino)propan-2-yl]-N-hexyl-5-isoquinolinesulfonamide IUPAC Name: N-[1-(diethylamino)propan-2-yl]-N-hexylisoquinoline-5-sulfonamide Traditional Name: N-[2-(diethylamino)-1-methyl-ethyl]-N-hexyl-isoquinoline-5-sulfonamide Formula: C22H35N3O2S MolecularWeight: 405.5972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35N3O2S/c1-5-8-9-10-16-25(19(4)18-24(6-2)7-3)28(26,27)22-13-11-12-20-17-23-15-14-21(20)22/h11-15,17,19H,5-10,16,18H2,1-4H3