2-fluoranyl-N-[[4-(2-methoxyphenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 2-fluoranyl-N-[[4-(2-methoxyphenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 2-fluoro-N-[[4-(2-methoxyphenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 2-fluoro-N-[[4-(2-methoxyphenyl)-5-(phenacylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 2-fluoro-N-[[4-(2-methoxyphenyl)-5-phenacylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 2-fluoro-N-[[4-(2-methoxyphenyl)-5-(phenacylthio)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C25H21FN4O3S MolecularWeight: 476.522643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NN=C2SCC(=O)C3=CC=CC=C3)CNC(=O)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC=CC=C1N2C(=NN=C2SCC(=O)C3=CC=CC=C3)CNC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H21FN4O3S/c1-33-22-14-8-7-13-20(22)30-23(15-27-24(32)18-11-5-6-12-19(18)26)28-29-25(30)34-16-21(31)17-9-3-2-4-10-17/h2-14H,15-16H2,1H3,(H,27,32)