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

Systemtic Name: 4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-3-fluoranyl-benzenecarbonitrile hydrochloride Openeye Name: 4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-3-fluoro-benzonitrile hydrochloride CAS Name: 4-[(4,5-dihydro-1H-imidazol-2-ylthio)methyl]-3-fluorobenzonitrile hydrochloride IUPAC Name: 4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-3-fluorobenzonitrile hydrochloride Traditional Name: 3-fluoro-4-[(2-imidazolin-2-ylthio)methyl]benzonitrile hydrochloride Formula: C11H11ClFN3S MolecularWeight: 271.741543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10FN3S.ClH/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);1H