N-[bis(azanyl)methylidene]-4-cyclohexylsulfinyl-2-ethyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-cyclohexylsulfinyl-2-ethyl-5-methylsulfonyl-benzamide Openeye Name: 4-cyclohexylsulfinyl-N-(diaminomethylene)-2-ethyl-5-methylsulfonyl-benzamide CAS Name: 4-cyclohexylsulfinyl-N-(diaminomethylidene)-2-ethyl-5-methylsulfonylbenzamide IUPAC Name: 4-cyclohexylsulfinyl-N-(diaminomethylidene)-2-ethyl-5-methylsulfonylbenzamide Traditional Name: 4-cyclohexylsulfinyl-N-(diaminomethylene)-2-ethyl-5-mesyl-benzamide Formula: C17H25N3O4S2 MolecularWeight: 399.5281

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)S(=O)C2CCCCC2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)S(=O)C2CCCCC2

InChI

InChI=1S/C17H25N3O4S2/c1-3-11-9-14(25(22)12-7-5-4-6-8-12)15(26(2,23)24)10-13(11)16(21)20-17(18)19/h9-10,12H,3-8H2,1-2H3,(H4,18,19,20,21)