N-(1-piperazin-1-ylethyl)isoquinoline-5-sulfonamide

Systemtic Name: N-(1-piperazin-1-ylethyl)isoquinoline-5-sulfonamide Openeye Name: N-(1-piperazin-1-ylethyl)isoquinoline-5-sulfonamide CAS Name: N-[1-(1-piperazinyl)ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-(1-piperazin-1-ylethyl)isoquinoline-5-sulfonamide Traditional Name: N-(1-piperazinoethyl)isoquinoline-5-sulfonamide Formula: C15H20N4O2S MolecularWeight: 320.4099

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Descriptors Computed from Structure

Canonical SMILES:

CC(NS(=O)(=O)C1=CC=CC2=C1C=CN=C2)N3CCNCC3

Isomeric SMILES

CC(NS(=O)(=O)C1=CC=CC2=C1C=CN=C2)N3CCNCC3

InChI

InChI=1S/C15H20N4O2S/c1-12(19-9-7-16-8-10-19)18-22(20,21)15-4-2-3-13-11-17-6-5-14(13)15/h2-6,11-12,16,18H,7-10H2,1H3