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

Systemtic Name: 4-[[4-azanyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-butan-1-one Openeye Name: 4-[[4-amino-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenyl-butan-1-one CAS Name: 4-[[4-amino-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]-1-phenyl-1-butanone IUPAC Name: 4-[[4-amino-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenylbutan-1-one Traditional Name: 4-[[4-amino-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]-1-phenyl-butan-1-one Formula: C18H17FN4OS MolecularWeight: 356.417183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCCSC2=NN=C(N2N)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCCSC2=NN=C(N2N)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H17FN4OS/c19-15-10-8-14(9-11-15)17-21-22-18(23(17)20)25-12-4-7-16(24)13-5-2-1-3-6-13/h1-3,5-6,8-11H,4,7,12,20H2