2-[2-(4-fluorophenyl)-5-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]ethanenitrile

Systemtic Name: 2-[2-(4-fluorophenyl)-5-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]ethanenitrile Openeye Name: 2-[2-(4-fluorophenyl)-5-(4-methylsulfanylphenyl)oxazol-4-yl]acetonitrile CAS Name: 2-[2-(4-fluorophenyl)-5-[4-(methylthio)phenyl]-4-oxazolyl]acetonitrile IUPAC Name: 2-[2-(4-fluorophenyl)-5-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]acetonitrile Traditional Name: 2-[2-(4-fluorophenyl)-5-[4-(methylthio)phenyl]oxazol-4-yl]acetonitrile Formula: C18H13FN2OS MolecularWeight: 324.372023

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(N=C(O2)C3=CC=C(C=C3)F)CC#N

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(N=C(O2)C3=CC=C(C=C3)F)CC#N

InChI

InChI=1S/C18H13FN2OS/c1-23-15-8-4-12(5-9-15)17-16(10-11-20)21-18(22-17)13-2-6-14(19)7-3-13/h2-9H,10H2,1H3