4-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-butan-1-one

Systemtic Name: 4-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-butan-1-one Openeye Name: 4-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-butan-1-one CAS Name: 4-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-phenyl-1-butanone IUPAC Name: 4-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenylbutan-1-one Traditional Name: 4-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-phenyl-butan-1-one Formula: C19H18FN3OS MolecularWeight: 355.429123

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCC(=O)C2=CC=CC=C2)C3=CC=CC=C3F

Isomeric SMILES

CN1C(=NN=C1SCCCC(=O)C2=CC=CC=C2)C3=CC=CC=C3F

InChI

InChI=1S/C19H18FN3OS/c1-23-18(15-10-5-6-11-16(15)20)21-22-19(23)25-13-7-12-17(24)14-8-3-2-4-9-14/h2-6,8-11H,7,12-13H2,1H3