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

Systemtic Name: N-[bis(azanyl)methylidene]-4-cyclohexylsulfanyl-2-ethyl-5-methylsulfonyl-benzamide Openeye Name: 4-cyclohexylsulfanyl-N-(diaminomethylene)-2-ethyl-5-methylsulfonyl-benzamide CAS Name: 4-(cyclohexylthio)-N-(diaminomethylidene)-2-ethyl-5-methylsulfonylbenzamide IUPAC Name: 4-cyclohexylsulfanyl-N-(diaminomethylidene)-2-ethyl-5-methylsulfonylbenzamide Traditional Name: 4-(cyclohexylthio)-N-(diaminomethylene)-2-ethyl-5-mesyl-benzamide Formula: C17H25N3O3S2 MolecularWeight: 383.5287

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)SC2CCCCC2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)SC2CCCCC2

InChI

InChI=1S/C17H25N3O3S2/c1-3-11-9-14(24-12-7-5-4-6-8-12)15(25(2,22)23)10-13(11)16(21)20-17(18)19/h9-10,12H,3-8H2,1-2H3,(H4,18,19,20,21)