N-[bis(azanyl)methylidene]-4-(4-methylphenyl)-5-methylsulfonyl-2-(trifluoromethyl)benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-(4-methylphenyl)-5-methylsulfonyl-2-(trifluoromethyl)benzamide Openeye Name: N-(diaminomethylene)-5-methylsulfonyl-4-(p-tolyl)-2-(trifluoromethyl)benzamide CAS Name: N-(diaminomethylidene)-4-(4-methylphenyl)-5-methylsulfonyl-2-(trifluoromethyl)benzamide IUPAC Name: N-(diaminomethylidene)-4-(4-methylphenyl)-5-methylsulfonyl-2-(trifluoromethyl)benzamide Traditional Name: N-(diaminomethylene)-5-mesyl-4-(p-tolyl)-2-(trifluoromethyl)benzamide Formula: C17H16F3N3O3S MolecularWeight: 399.38745

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C=C2S(=O)(=O)C)C(=O)N=C(N)N)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C=C2S(=O)(=O)C)C(=O)N=C(N)N)C(F)(F)F

InChI

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