N-[bis(azanyl)methylidene]-4-chloranyl-2-ethynyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-chloranyl-2-ethynyl-5-methylsulfonyl-benzamide Openeye Name: 4-chloro-N-(diaminomethylene)-2-ethynyl-5-methylsulfonyl-benzamide CAS Name: 4-chloro-N-(diaminomethylidene)-2-ethynyl-5-methylsulfonylbenzamide IUPAC Name: 4-chloro-N-(diaminomethylidene)-2-ethynyl-5-methylsulfonylbenzamide Traditional Name: 4-chloro-N-(diaminomethylene)-2-ethynyl-5-mesyl-benzamide Formula: C11H10ClN3O3S MolecularWeight: 299.7334

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)N=C(N)N)C#C)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)N=C(N)N)C#C)Cl

InChI

InChI=1S/C11H10ClN3O3S/c1-3-6-4-8(12)9(19(2,17)18)5-7(6)10(16)15-11(13)14/h1,4-5H,2H3,(H4,13,14,15,16)