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

Systemtic Name: 4-fluoranyl-N-[2-[5-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: 4-fluoro-N-[2-[5-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide CAS Name: 4-fluoro-N-[2-[5-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: 4-fluoro-N-[2-[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: 4-fluoro-N-[2-[5-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)OC)CCNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)OC)CCNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O3S/c1-26-19(11-12-23-20(28)15-3-7-16(22)8-4-15)24-25-21(26)30-13-18(27)14-5-9-17(29-2)10-6-14/h3-10H,11-13H2,1-2H3,(H,23,28)