2-[3-(isoquinolin-5-ylsulfonylamino)hexyl]guanidine

Systemtic Name: 2-[3-(isoquinolin-5-ylsulfonylamino)hexyl]guanidine Openeye Name: 2-[3-(5-isoquinolylsulfonylamino)hexyl]guanidine CAS Name: 2-[3-(5-isoquinolinylsulfonylamino)hexyl]guanidine IUPAC Name: 2-[3-(isoquinolin-5-ylsulfonylamino)hexyl]guanidine Traditional Name: 2-[3-(5-isoquinolylsulfonylamino)hexyl]guanidine Formula: C16H23N5O2S MolecularWeight: 349.45112

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCN=C(N)N)NS(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCC(CCN=C(N)N)NS(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C16H23N5O2S/c1-2-4-13(7-10-20-16(17)18)21-24(22,23)15-6-3-5-12-11-19-9-8-14(12)15/h3,5-6,8-9,11,13,21H,2,4,7,10H2,1H3,(H4,17,18,20)