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

Systemtic Name: N-[bis(azanyl)methylidene]-4-tert-butylsulfonyl-2-ethyl-5-nitro-benzamide Openeye Name: 4-tert-butylsulfonyl-N-(diaminomethylene)-2-ethyl-5-nitro-benzamide CAS Name: 4-tert-butylsulfonyl-N-(diaminomethylidene)-2-ethyl-5-nitrobenzamide IUPAC Name: 4-tert-butylsulfonyl-N-(diaminomethylidene)-2-ethyl-5-nitrobenzamide Traditional Name: 4-tert-butylsulfonyl-N-(diaminomethylene)-2-ethyl-5-nitro-benzamide Formula: C14H20N4O5S MolecularWeight: 356.3974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C(C)(C)C

InChI

InChI=1S/C14H20N4O5S/c1-5-8-6-11(24(22,23)14(2,3)4)10(18(20)21)7-9(8)12(19)17-13(15)16/h6-7H,5H2,1-4H3,(H4,15,16,17,19)