N-[bis(azanyl)methylidene]-4-cycloheptylsulfonyl-2-ethyl-5-(trifluoromethyl)benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-cycloheptylsulfonyl-2-ethyl-5-(trifluoromethyl)benzamide Openeye Name: 4-cycloheptylsulfonyl-N-(diaminomethylene)-2-ethyl-5-(trifluoromethyl)benzamide CAS Name: 4-cycloheptylsulfonyl-N-(diaminomethylidene)-2-ethyl-5-(trifluoromethyl)benzamide IUPAC Name: 4-cycloheptylsulfonyl-N-(diaminomethylidene)-2-ethyl-5-(trifluoromethyl)benzamide Traditional Name: 4-cycloheptylsulfonyl-N-(diaminomethylene)-2-ethyl-5-(trifluoromethyl)benzamide Formula: C18H24F3N3O3S MolecularWeight: 419.46167

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)C(F)(F)F)S(=O)(=O)C2CCCCCC2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)C(F)(F)F)S(=O)(=O)C2CCCCCC2

InChI

InChI=1S/C18H24F3N3O3S/c1-2-11-9-15(28(26,27)12-7-5-3-4-6-8-12)14(18(19,20)21)10-13(11)16(25)24-17(22)23/h9-10,12H,2-8H2,1H3,(H4,22,23,24,25)