N-methyl-N-[5-methyl-6-(propylamino)hexyl]isoquinoline-5-sulfonamide

Systemtic Name: N-methyl-N-[5-methyl-6-(propylamino)hexyl]isoquinoline-5-sulfonamide Openeye Name: N-methyl-N-[5-methyl-6-(propylamino)hexyl]isoquinoline-5-sulfonamide CAS Name: N-methyl-N-[5-methyl-6-(propylamino)hexyl]-5-isoquinolinesulfonamide IUPAC Name: N-methyl-N-[5-methyl-6-(propylamino)hexyl]isoquinoline-5-sulfonamide Traditional Name: N-methyl-N-[5-methyl-6-(propylamino)hexyl]isoquinoline-5-sulfonamide Formula: C20H31N3O2S MolecularWeight: 377.54404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O2S/c1-4-12-21-15-17(2)8-5-6-14-23(3)26(24,25)20-10-7-9-18-16-22-13-11-19(18)20/h7,9-11,13,16-17,21H,4-6,8,12,14-15H2,1-3H3