N-[bis(azanyl)methylidene]-4-tert-butyl-3-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-tert-butyl-3-methylsulfonyl-benzamide Openeye Name: 4-tert-butyl-N-(diaminomethylene)-3-methylsulfonyl-benzamide CAS Name: 4-tert-butyl-N-(diaminomethylidene)-3-methylsulfonylbenzamide IUPAC Name: 4-tert-butyl-N-(diaminomethylidene)-3-methylsulfonylbenzamide Traditional Name: 4-tert-butyl-N-(diaminomethylene)-3-mesyl-benzamide Formula: C13H19N3O3S MolecularWeight: 297.37326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O3S/c1-13(2,3)9-6-5-8(11(17)16-12(14)15)7-10(9)20(4,18)19/h5-7H,1-4H3,(H4,14,15,16,17)