1-(4-fluorophenyl)-3-(4-methylphenyl)sulfanyl-2-(1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-(4-fluorophenyl)-3-(4-methylphenyl)sulfanyl-2-(1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-(4-fluorophenyl)-3-(p-tolylsulfanyl)-2-(1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-(4-fluorophenyl)-3-[(4-methylphenyl)thio]-2-(1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-(4-fluorophenyl)-3-(4-methylphenyl)sulfanyl-2-(1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-(4-fluorophenyl)-3-(p-tolylthio)-2-(1,2,4-triazol-1-yl)propan-1-one Formula: C18H16FN3OS MolecularWeight: 341.402543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(C(=O)C2=CC=C(C=C2)F)N3C=NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)SCC(C(=O)C2=CC=C(C=C2)F)N3C=NC=N3

InChI

InChI=1S/C18H16FN3OS/c1-13-2-8-16(9-3-13)24-10-17(22-12-20-11-21-22)18(23)14-4-6-15(19)7-5-14/h2-9,11-12,17H,10H2,1H3