2-[7-(isoquinolin-5-ylsulfonylamino)octan-2-yl]guanidine

Systemtic Name: 2-[7-(isoquinolin-5-ylsulfonylamino)octan-2-yl]guanidine Openeye Name: 2-[6-(5-isoquinolylsulfonylamino)-1-methyl-heptyl]guanidine CAS Name: 2-[7-(5-isoquinolinylsulfonylamino)octan-2-yl]guanidine IUPAC Name: 2-[7-(isoquinolin-5-ylsulfonylamino)octan-2-yl]guanidine Traditional Name: 2-[6-(5-isoquinolylsulfonylamino)-1-methyl-heptyl]guanidine Formula: C18H27N5O2S MolecularWeight: 377.50428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N5O2S/c1-13(22-18(19)20)6-3-4-7-14(2)23-26(24,25)17-9-5-8-15-12-21-11-10-16(15)17/h5,8-14,23H,3-4,6-7H2,1-2H3,(H4,19,20,22)