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

Systemtic Name: N-[bis(azanyl)methylidene]-3-ethanoyl-5-methylsulfonyl-benzamide hydrochloride Openeye Name: 3-acetyl-N-(diaminomethylene)-5-methylsulfonyl-benzamide hydrochloride CAS Name: 3-acetyl-N-(diaminomethylidene)-5-methylsulfonylbenzamide hydrochloride IUPAC Name: 3-acetyl-N-(diaminomethylidene)-5-methylsulfonylbenzamide hydrochloride Traditional Name: 3-acetyl-N-(diaminomethylene)-5-mesyl-benzamide hydrochloride Formula: C11H14ClN3O4S MolecularWeight: 319.76456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O4S.ClH/c1-6(15)7-3-8(10(16)14-11(12)13)5-9(4-7)19(2,17)18;/h3-5H,1-2H3,(H4,12,13,14,16);1H