3-azanyl-N-[bis(azanyl)methylidene]-5-methylsulfonyl-benzamide dihydrochloride

Systemtic Name: 3-azanyl-N-[bis(azanyl)methylidene]-5-methylsulfonyl-benzamide dihydrochloride Openeye Name: 3-amino-N-(diaminomethylene)-5-methylsulfonyl-benzamide dihydrochloride CAS Name: 3-amino-N-(diaminomethylidene)-5-methylsulfonylbenzamide dihydrochloride IUPAC Name: 3-amino-N-(diaminomethylidene)-5-methylsulfonylbenzamide dihydrochloride Traditional Name: 3-amino-N-(diaminomethylene)-5-mesyl-benzamide dihydrochloride Formula: C9H14Cl2N4O3S MolecularWeight: 329.20346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CC(=C1)N)C(=O)N=C(N)N.Cl.Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=CC(=C1)N)C(=O)N=C(N)N.Cl.Cl

InChI

InChI=1S/C9H12N4O3S.2ClH/c1-17(15,16)7-3-5(2-6(10)4-7)8(14)13-9(11)12;;/h2-4H,10H2,1H3,(H4,11,12,13,14);2*1H