bis(azanyl)methylidene-[2-(isoquinolin-5-ylsulfonylamino)ethyl]azanium

Systemtic Name: bis(azanyl)methylidene-[2-(isoquinolin-5-ylsulfonylamino)ethyl]azanium Openeye Name: diaminomethylene-[2-(5-isoquinolylsulfonylamino)ethyl]ammonium CAS Name: diaminomethylidene-[2-(5-isoquinolinylsulfonylamino)ethyl]ammonium IUPAC Name: diaminomethylidene-[2-(isoquinolin-5-ylsulfonylamino)ethyl]azanium Traditional Name: diaminomethylene-[2-(5-isoquinolylsulfonylamino)ethyl]ammonium Formula: C12H16N5O2S+ MolecularWeight: 294.35274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NCC[NH+]=C(N)N

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NCC[NH+]=C(N)N

InChI

InChI=1S/C12H15N5O2S/c13-12(14)16-6-7-17-20(18,19)11-3-1-2-9-8-15-5-4-10(9)11/h1-5,8,17H,6-7H2,(H4,13,14,16)/p+1