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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=C3F

Isomeric SMILES

CC(=O)CCSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=C3F

InChI

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