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

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-4-(phenylsulfonyl)-5-(trifluoromethyl)benzamide Openeye Name: 4-(benzenesulfonyl)-N-(diaminomethylene)-2-ethyl-5-(trifluoromethyl)benzamide CAS Name: 4-(benzenesulfonyl)-N-(diaminomethylidene)-2-ethyl-5-(trifluoromethyl)benzamide IUPAC Name: 4-(benzenesulfonyl)-N-(diaminomethylidene)-2-ethyl-5-(trifluoromethyl)benzamide Traditional Name: 4-besyl-N-(diaminomethylene)-2-ethyl-5-(trifluoromethyl)benzamide Formula: C17H16F3N3O3S MolecularWeight: 399.38745

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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)C2=CC=CC=C2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)C(F)(F)F)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16F3N3O3S/c1-2-10-8-14(27(25,26)11-6-4-3-5-7-11)13(17(18,19)20)9-12(10)15(24)23-16(21)22/h3-9H,2H2,1H3,(H4,21,22,23,24)