N-[bis(azanyl)methylidene]-4-tert-butylsulfonyl-2-methyl-5-nitro-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-tert-butylsulfonyl-2-methyl-5-nitro-benzamide Openeye Name: 4-tert-butylsulfonyl-N-(diaminomethylene)-2-methyl-5-nitro-benzamide CAS Name: 4-tert-butylsulfonyl-N-(diaminomethylidene)-2-methyl-5-nitrobenzamide IUPAC Name: 4-tert-butylsulfonyl-N-(diaminomethylidene)-2-methyl-5-nitrobenzamide Traditional Name: 4-tert-butylsulfonyl-N-(diaminomethylene)-2-methyl-5-nitro-benzamide Formula: C13H18N4O5S MolecularWeight: 342.37082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C(C)(C)C

InChI

InChI=1S/C13H18N4O5S/c1-7-5-10(23(21,22)13(2,3)4)9(17(19)20)6-8(7)11(18)16-12(14)15/h5-6H,1-4H3,(H4,14,15,16,18)