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N-[2-[bis(azanyl)methylideneamino]ethyl]isoquinoline-3-carboxamide; sulfurous acid

N-[2-[bis(azanyl)methylideneamino]ethyl]isoquinoline-3-carboxamide; sulfurous acid

Systemtic Name:N-[2-[bis(azanyl)methylideneamino]ethyl]isoquinoline-3-carboxamide; sulfurous acid
Openeye Name:N-(2-guanidinoethyl)isoquinoline-3-carboxamide; sulfurous acid
CAS Name:N-[2-(diaminomethylideneamino)ethyl]-3-isoquinolinecarboxamide; sulfurous acid
IUPAC Name:N-[2-(diaminomethylideneamino)ethyl]isoquinoline-3-carboxamide; sulfurous acid
Traditional Name:N-(2-guanidinoethyl)isoquinoline-3-carboxamide; sulfurous acid
Formula: C13H17N5O4S
MolecularWeight: 339.37018
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)C(=O)NCCN=C(N)N.OS(=O)O


Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)C(=O)NCCN=C(N)N.OS(=O)O


InChI

InChI=1S/C13H15N5O.H2O3S/c14-13(15)17-6-5-16-12(19)11-7-9-3-1-2-4-10(9)8-18-11;1-4(2)3/h1-4,7-8H,5-6H2,(H,16,19)(H4,14,15,17);(H2,1,2,3)


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