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

Systemtic Name: N-[bis(azanyl)methylidene]-3-ethanoyl-5-methylsulfonyl-benzamide Openeye Name: 3-acetyl-N-(diaminomethylene)-5-methylsulfonyl-benzamide CAS Name: 3-acetyl-N-(diaminomethylidene)-5-methylsulfonylbenzamide IUPAC Name: 3-acetyl-N-(diaminomethylidene)-5-methylsulfonylbenzamide Traditional Name: 3-acetyl-N-(diaminomethylene)-5-mesyl-benzamide Formula: C11H13N3O4S MolecularWeight: 283.30362

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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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O4S/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)