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

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-4-pentylsulfonyl-5-(trifluoromethyl)benzamide Openeye Name: N-(diaminomethylene)-2-ethyl-4-pentylsulfonyl-5-(trifluoromethyl)benzamide CAS Name: N-(diaminomethylidene)-2-ethyl-4-pentylsulfonyl-5-(trifluoromethyl)benzamide IUPAC Name: N-(diaminomethylidene)-2-ethyl-4-pentylsulfonyl-5-(trifluoromethyl)benzamide Traditional Name: 4-amylsulfonyl-N-(diaminomethylene)-2-ethyl-5-(trifluoromethyl)benzamide Formula: C16H22F3N3O3S MolecularWeight: 393.42439

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)C1=C(C=C(C(=C1)CC)C(=O)N=C(N)N)C(F)(F)F

Isomeric SMILES

CCCCCS(=O)(=O)C1=C(C=C(C(=C1)CC)C(=O)N=C(N)N)C(F)(F)F

InChI

InChI=1S/C16H22F3N3O3S/c1-3-5-6-7-26(24,25)13-8-10(4-2)11(14(23)22-15(20)21)9-12(13)16(17,18)19/h8-9H,3-7H2,1-2H3,(H4,20,21,22,23)