N-[bis(azanyl)methylidene]-4-but-3-enyl-3-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-but-3-enyl-3-methylsulfonyl-benzamide Openeye Name: 4-but-3-enyl-N-(diaminomethylene)-3-methylsulfonyl-benzamide CAS Name: 4-but-3-enyl-N-(diaminomethylidene)-3-methylsulfonylbenzamide IUPAC Name: 4-but-3-enyl-N-(diaminomethylidene)-3-methylsulfonylbenzamide Traditional Name: 4-but-3-enyl-N-(diaminomethylene)-3-mesyl-benzamide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)CCC=C

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)CCC=C

InChI

InChI=1S/C13H17N3O3S/c1-3-4-5-9-6-7-10(12(17)16-13(14)15)8-11(9)20(2,18)19/h3,6-8H,1,4-5H2,2H3,(H4,14,15,16,17)