1-(4-fluorophenyl)-2-[(4-phenyl-5-phenylazanyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-fluorophenyl)-2-[(4-phenyl-5-phenylazanyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 2-[(5-anilino-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)ethanone CAS Name: 2-[(5-anilino-4-phenyl-1,2,4-triazol-3-yl)thio]-1-(4-fluorophenyl)ethanone IUPAC Name: 2-[(5-anilino-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)ethanone Traditional Name: 2-[(5-anilino-4-phenyl-1,2,4-triazol-3-yl)thio]-1-(4-fluorophenyl)ethanone Formula: C22H17FN4OS MolecularWeight: 404.459983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(N2C3=CC=CC=C3)SCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(N2C3=CC=CC=C3)SCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN4OS/c23-17-13-11-16(12-14-17)20(28)15-29-22-26-25-21(24-18-7-3-1-4-8-18)27(22)19-9-5-2-6-10-19/h1-14H,15H2,(H,24,25)