3-[2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]benzimidazol-1-yl]propanenitrile

Systemtic Name: 3-[2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]benzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]benzimidazol-1-yl]propanenitrile CAS Name: 3-[2-[(3-fluoro-4-methoxyphenyl)methylthio]-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]benzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-[(3-fluoro-4-methoxy-benzyl)thio]benzimidazol-1-yl]propionitrile Formula: C18H16FN3OS MolecularWeight: 341.402543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3N2CCC#N)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3N2CCC#N)F

InChI

InChI=1S/C18H16FN3OS/c1-23-17-8-7-13(11-14(17)19)12-24-18-21-15-5-2-3-6-16(15)22(18)10-4-9-20/h2-3,5-8,11H,4,10,12H2,1H3