2-chloranyl-6-fluoranyl-N-[[4-(2-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 2-chloranyl-6-fluoranyl-N-[[4-(2-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 2-chloro-6-fluoro-N-[[4-(2-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 2-chloro-6-fluoro-N-[[4-(2-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 2-chloro-6-fluoro-N-[[4-(2-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 2-chloro-6-fluoro-N-[[4-(2-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methyl]benzamide Formula: C17H14ClFN4O2S MolecularWeight: 392.835063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NNC2=S)CNC(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

COC1=CC=CC=C1N2C(=NNC2=S)CNC(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H14ClFN4O2S/c1-25-13-8-3-2-7-12(13)23-14(21-22-17(23)26)9-20-16(24)15-10(18)5-4-6-11(15)19/h2-8H,9H2,1H3,(H,20,24)(H,22,26)