[3-(4-chlorophenyl)-5-[2,2,2-tris(fluoranyl)ethylsulfanyl]-1,2,4-triazol-1-yl]-morpholin-4-yl-methanone

Systemtic Name: [3-(4-chlorophenyl)-5-[2,2,2-tris(fluoranyl)ethylsulfanyl]-1,2,4-triazol-1-yl]-morpholin-4-yl-methanone Openeye Name: [3-(4-chlorophenyl)-5-(2,2,2-trifluoroethylsulfanyl)-1,2,4-triazol-1-yl]-morpholino-methanone CAS Name: [3-(4-chlorophenyl)-5-(2,2,2-trifluoroethylthio)-1,2,4-triazol-1-yl]-(4-morpholinyl)methanone IUPAC Name: [3-(4-chlorophenyl)-5-(2,2,2-trifluoroethylsulfanyl)-1,2,4-triazol-1-yl]-morpholin-4-ylmethanone Traditional Name: [3-(4-chlorophenyl)-5-(2,2,2-trifluoroethylthio)-1,2,4-triazol-1-yl]-morpholino-methanone Formula: C15H14ClF3N4O2S MolecularWeight: 406.81047

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)N2C(=NC(=N2)C3=CC=C(C=C3)Cl)SCC(F)(F)F

Isomeric SMILES

C1COCCN1C(=O)N2C(=NC(=N2)C3=CC=C(C=C3)Cl)SCC(F)(F)F

InChI

InChI=1S/C15H14ClF3N4O2S/c16-11-3-1-10(2-4-11)12-20-13(26-9-15(17,18)19)23(21-12)14(24)22-5-7-25-8-6-22/h1-4H,5-9H2