2-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)methyl]guanidine; sulfuric acid

Systemtic Name: 2-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)methyl]guanidine; sulfuric acid Openeye Name: 2-[(3-ethyl-4-oxo-phthalazin-1-yl)methyl]guanidine; sulfuric acid CAS Name: 2-[(3-ethyl-4-oxo-1-phthalazinyl)methyl]guanidine; sulfuric acid IUPAC Name: 2-[(3-ethyl-4-oxophthalazin-1-yl)methyl]guanidine; sulfuric acid Traditional Name: 2-[(3-ethyl-4-keto-phthalazin-1-yl)methyl]guanidine; sulfuric acid Formula: C24H32N10O6S MolecularWeight: 588.63928

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)CN=C(N)N.CCN1C(=O)C2=CC=CC=C2C(=N1)CN=C(N)N.OS(=O)(=O)O

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)CN=C(N)N.CCN1C(=O)C2=CC=CC=C2C(=N1)CN=C(N)N.OS(=O)(=O)O

InChI

InChI=1S/2C12H15N5O.H2O4S/c2*1-2-17-11(18)9-6-4-3-5-8(9)10(16-17)7-15-12(13)14;1-5(2,3)4/h2*3-6H,2,7H2,1H3,(H4,13,14,15);(H2,1,2,3,4)