4-[[4,5-bis(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile

Systemtic Name: 4-[[4,5-bis(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Openeye Name: 4-[[4,5-bis(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile CAS Name: 4-[[4,5-bis(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]butanenitrile IUPAC Name: 4-[[4,5-bis(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Traditional Name: 4-[[4,5-bis(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]butyronitrile Formula: C18H14F2N4S MolecularWeight: 356.392366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(N2C3=CC=C(C=C3)F)SCCCC#N)F

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(N2C3=CC=C(C=C3)F)SCCCC#N)F

InChI

InChI=1S/C18H14F2N4S/c19-14-5-3-13(4-6-14)17-22-23-18(25-12-2-1-11-21)24(17)16-9-7-15(20)8-10-16/h3-10H,1-2,12H2