N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-1-yl]-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(9,10-dioxo-1-anthryl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(9,10-dioxo-1-anthracenyl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(9,10-dioxoanthracen-1-yl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(9,10-diketo-1-anthryl)-2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H13F3N4O3S MolecularWeight: 446.40243

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(F)(F)F

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(F)(F)F

InChI

InChI=1S/C20H13F3N4O3S/c1-27-18(20(21,22)23)25-26-19(27)31-9-14(28)24-13-8-4-7-12-15(13)17(30)11-6-3-2-5-10(11)16(12)29/h2-8H,9H2,1H3,(H,24,28)