2-[2-[[(1-chloranylisoquinolin-5-yl)sulfonylamino]methyl]pentyl]guanidine

Systemtic Name: 2-[2-[[(1-chloranylisoquinolin-5-yl)sulfonylamino]methyl]pentyl]guanidine Openeye Name: 2-[2-[[(1-chloro-5-isoquinolyl)sulfonylamino]methyl]pentyl]guanidine CAS Name: 2-[2-[[(1-chloro-5-isoquinolinyl)sulfonylamino]methyl]pentyl]guanidine IUPAC Name: 2-[2-[[(1-chloroisoquinolin-5-yl)sulfonylamino]methyl]pentyl]guanidine Traditional Name: 2-[2-[[(1-chloro-5-isoquinolyl)sulfonylamino]methyl]pentyl]guanidine Formula: C16H22ClN5O2S MolecularWeight: 383.89618

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2Cl)CN=C(N)N

Isomeric SMILES

CCCC(CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2Cl)CN=C(N)N

InChI

InChI=1S/C16H22ClN5O2S/c1-2-4-11(9-21-16(18)19)10-22-25(23,24)14-6-3-5-13-12(14)7-8-20-15(13)17/h3,5-8,11,22H,2,4,9-10H2,1H3,(H4,18,19,21)