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

Systemtic Name: N-[bis(azanyl)methylidene]-4-cyclohexylsulfonyl-2-ethyl-5-nitro-benzamide Openeye Name: 4-cyclohexylsulfonyl-N-(diaminomethylene)-2-ethyl-5-nitro-benzamide CAS Name: 4-cyclohexylsulfonyl-N-(diaminomethylidene)-2-ethyl-5-nitrobenzamide IUPAC Name: 4-cyclohexylsulfonyl-N-(diaminomethylidene)-2-ethyl-5-nitrobenzamide Traditional Name: 4-cyclohexylsulfonyl-N-(diaminomethylene)-2-ethyl-5-nitro-benzamide Formula: C16H22N4O5S MolecularWeight: 382.43468

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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)C2CCCCC2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C2CCCCC2

InChI

InChI=1S/C16H22N4O5S/c1-2-10-8-14(26(24,25)11-6-4-3-5-7-11)13(20(22)23)9-12(10)15(21)19-16(17)18/h8-9,11H,2-7H2,1H3,(H4,17,18,19,21)