N-(2-azanylethyl)-N-butyl-isoquinoline-5-sulfonamide

Systemtic Name: N-(2-azanylethyl)-N-butyl-isoquinoline-5-sulfonamide Openeye Name: N-(2-aminoethyl)-N-butyl-isoquinoline-5-sulfonamide CAS Name: N-(2-aminoethyl)-N-butyl-5-isoquinolinesulfonamide IUPAC Name: N-(2-aminoethyl)-N-butylisoquinoline-5-sulfonamide Traditional Name: N-(2-aminoethyl)-N-butyl-isoquinoline-5-sulfonamide Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O2S/c1-2-3-10-18(11-8-16)21(19,20)15-6-4-5-13-12-17-9-7-14(13)15/h4-7,9,12H,2-3,8,10-11,16H2,1H3