N-[2-(butylamino)ethyl]-1-chloranyl-isoquinoline-5-sulfonamide

Systemtic Name: N-[2-(butylamino)ethyl]-1-chloranyl-isoquinoline-5-sulfonamide Openeye Name: N-[2-(butylamino)ethyl]-1-chloro-isoquinoline-5-sulfonamide CAS Name: N-[2-(butylamino)ethyl]-1-chloro-5-isoquinolinesulfonamide IUPAC Name: N-[2-(butylamino)ethyl]-1-chloroisoquinoline-5-sulfonamide Traditional Name: N-[2-(butylamino)ethyl]-1-chloro-isoquinoline-5-sulfonamide Formula: C15H20ClN3O2S MolecularWeight: 341.8562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2Cl

Isomeric SMILES

CCCCNCCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2Cl

InChI

InChI=1S/C15H20ClN3O2S/c1-2-3-8-17-10-11-19-22(20,21)14-6-4-5-13-12(14)7-9-18-15(13)16/h4-7,9,17,19H,2-3,8,10-11H2,1H3