2-[1-(isoquinolin-5-ylsulfonylamino)-3-methyl-butan-2-yl]guanidine

Systemtic Name: 2-[1-(isoquinolin-5-ylsulfonylamino)-3-methyl-butan-2-yl]guanidine Openeye Name: 2-[1-[(5-isoquinolylsulfonylamino)methyl]-2-methyl-propyl]guanidine CAS Name: 2-[1-(5-isoquinolinylsulfonylamino)-3-methylbutan-2-yl]guanidine IUPAC Name: 2-[1-(isoquinolin-5-ylsulfonylamino)-3-methylbutan-2-yl]guanidine Traditional Name: 2-[1-[(5-isoquinolylsulfonylamino)methyl]-2-methyl-propyl]guanidine Formula: C15H21N5O2S MolecularWeight: 335.42454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N5O2S/c1-10(2)13(20-15(16)17)9-19-23(21,22)14-5-3-4-11-8-18-7-6-12(11)14/h3-8,10,13,19H,9H2,1-2H3,(H4,16,17,20)