4-[[5-(2-azanylethyl)-2-methyl-imidazol-1-yl]methyl]-2-fluoranyl-benzenecarbonitrile dihydrochloride

Systemtic Name: 4-[[5-(2-azanylethyl)-2-methyl-imidazol-1-yl]methyl]-2-fluoranyl-benzenecarbonitrile dihydrochloride Openeye Name: 4-[[5-(2-aminoethyl)-2-methyl-imidazol-1-yl]methyl]-2-fluoro-benzonitrile dihydrochloride CAS Name: 4-[[5-(2-aminoethyl)-2-methyl-1-imidazolyl]methyl]-2-fluorobenzonitrile dihydrochloride IUPAC Name: 4-[[5-(2-aminoethyl)-2-methylimidazol-1-yl]methyl]-2-fluorobenzonitrile dihydrochloride Traditional Name: 4-[[5-(2-aminoethyl)-2-methyl-imidazol-1-yl]methyl]-2-fluoro-benzonitrile dihydrochloride Formula: C14H17Cl2FN4 MolecularWeight: 331.215983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CC2=CC(=C(C=C2)C#N)F)CCN.Cl.Cl

Isomeric SMILES

CC1=NC=C(N1CC2=CC(=C(C=C2)C#N)F)CCN.Cl.Cl

InChI

InChI=1S/C14H15FN4.2ClH/c1-10-18-8-13(4-5-16)19(10)9-11-2-3-12(7-17)14(15)6-11;;/h2-3,6,8H,4-5,9,16H2,1H3;2*1H