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

Systemtic Name: N-hexyl-N-[1-(propan-2-ylamino)propan-2-yl]isoquinoline-5-sulfonamide Openeye Name: N-hexyl-N-[2-(isopropylamino)-1-methyl-ethyl]isoquinoline-5-sulfonamide CAS Name: N-hexyl-N-[1-(propan-2-ylamino)propan-2-yl]-5-isoquinolinesulfonamide IUPAC Name: N-hexyl-N-[1-(propan-2-ylamino)propan-2-yl]isoquinoline-5-sulfonamide Traditional Name: N-hexyl-N-[2-(isopropylamino)-1-methyl-ethyl]isoquinoline-5-sulfonamide Formula: C21H33N3O2S MolecularWeight: 391.57062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3O2S/c1-5-6-7-8-14-24(18(4)15-23-17(2)3)27(25,26)21-11-9-10-19-16-22-13-12-20(19)21/h9-13,16-18,23H,5-8,14-15H2,1-4H3