2-[4-azanyl-1-(1-methylimidazol-2-yl)butoxy]-4-chloranyl-5-fluoranyl-benzenecarbonitrile hydrochloride

Systemtic Name: 2-[4-azanyl-1-(1-methylimidazol-2-yl)butoxy]-4-chloranyl-5-fluoranyl-benzenecarbonitrile hydrochloride Openeye Name: 2-[4-amino-1-(1-methylimidazol-2-yl)butoxy]-4-chloro-5-fluoro-benzonitrile hydrochloride CAS Name: 2-[4-amino-1-(1-methyl-2-imidazolyl)butoxy]-4-chloro-5-fluorobenzonitrile hydrochloride IUPAC Name: 2-[4-amino-1-(1-methylimidazol-2-yl)butoxy]-4-chloro-5-fluorobenzonitrile hydrochloride Traditional Name: 2-[4-amino-1-(1-methylimidazol-2-yl)butoxy]-4-chloro-5-fluoro-benzonitrile hydrochloride Formula: C15H17Cl2FN4O MolecularWeight: 359.226083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(CCCN)OC2=CC(=C(C=C2C#N)F)Cl.Cl

Isomeric SMILES

CN1C=CN=C1C(CCCN)OC2=CC(=C(C=C2C#N)F)Cl.Cl

InChI

InChI=1S/C15H16ClFN4O.ClH/c1-21-6-5-20-15(21)13(3-2-4-18)22-14-8-11(16)12(17)7-10(14)9-19;/h5-8,13H,2-4,18H2,1H3;1H