N-[2-[5-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]ethyl]ethanamide

Systemtic Name: N-[2-[5-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]ethyl]ethanamide Openeye Name: N-[2-[5-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-4-(p-tolyl)-1,2,4-triazol-3-yl]ethyl]acetamide CAS Name: N-[2-[5-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]ethyl]acetamide IUPAC Name: N-[2-[5-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]ethyl]acetamide Traditional Name: N-[2-[5-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]-4-(p-tolyl)-1,2,4-triazol-3-yl]ethyl]acetamide Formula: C21H21FN4O2S MolecularWeight: 412.480443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)F)CCNC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)F)CCNC(=O)C

InChI

InChI=1S/C21H21FN4O2S/c1-14-3-9-18(10-4-14)26-20(11-12-23-15(2)27)24-25-21(26)29-13-19(28)16-5-7-17(22)8-6-16/h3-10H,11-13H2,1-2H3,(H,23,27)