2-[1-(isoquinolin-5-ylsulfonylamino)butan-2-yl]guanidine

Systemtic Name: 2-[1-(isoquinolin-5-ylsulfonylamino)butan-2-yl]guanidine Openeye Name: 2-[1-[(5-isoquinolylsulfonylamino)methyl]propyl]guanidine CAS Name: 2-[1-(5-isoquinolinylsulfonylamino)butan-2-yl]guanidine IUPAC Name: 2-[1-(isoquinolin-5-ylsulfonylamino)butan-2-yl]guanidine Traditional Name: 2-[1-[(5-isoquinolylsulfonylamino)methyl]propyl]guanidine Formula: C14H19N5O2S MolecularWeight: 321.39796

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2)N=C(N)N

Isomeric SMILES

CCC(CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2)N=C(N)N

InChI

InChI=1S/C14H19N5O2S/c1-2-11(19-14(15)16)9-18-22(20,21)13-5-3-4-10-8-17-7-6-12(10)13/h3-8,11,18H,2,9H2,1H3,(H4,15,16,19)