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

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-4-(2-methylcyclopentyl)sulfonyl-5-nitro-benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-4-(2-methylcyclopentyl)sulfonyl-5-nitro-benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-4-(2-methylcyclopentyl)sulfonyl-5-nitrobenzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-4-(2-methylcyclopentyl)sulfonyl-5-nitrobenzamide Traditional Name: N-(diaminomethylene)-2-ethyl-4-(2-methylcyclopentyl)sulfonyl-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)C2CCCC2C

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])S(=O)(=O)C2CCCC2C

InChI

InChI=1S/C16H22N4O5S/c1-3-10-7-14(26(24,25)13-6-4-5-9(13)2)12(20(22)23)8-11(10)15(21)19-16(17)18/h7-9,13H,3-6H2,1-2H3,(H4,17,18,19,21)