4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-3-fluoro-benzonitrile CAS Name: 4-[(4,5-dihydro-1H-imidazol-2-ylthio)methyl]-3-fluorobenzonitrile IUPAC Name: 4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-3-fluorobenzonitrile Traditional Name: 3-fluoro-4-[(2-imidazolin-2-ylthio)methyl]benzonitrile Formula: C11H10FN3S MolecularWeight: 235.280603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)SCC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

C1CN=C(N1)SCC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C11H10FN3S/c12-10-5-8(6-13)1-2-9(10)7-16-11-14-3-4-15-11/h1-2,5H,3-4,7H2,(H,14,15)