4-chloranyl-2-[5-[2-(1H-imidazol-5-yl)ethylamino]pentan-2-yloxy]benzenecarbonitrile

Systemtic Name: 4-chloranyl-2-[5-[2-(1H-imidazol-5-yl)ethylamino]pentan-2-yloxy]benzenecarbonitrile Openeye Name: 4-chloro-2-[4-[2-(1H-imidazol-5-yl)ethylamino]-1-methyl-butoxy]benzonitrile CAS Name: 4-chloro-2-[5-[2-(1H-imidazol-5-yl)ethylamino]pentan-2-yloxy]benzonitrile IUPAC Name: 4-chloro-2-[5-[2-(1H-imidazol-5-yl)ethylamino]pentan-2-yloxy]benzonitrile Traditional Name: 4-chloro-2-[4-[2-(1H-imidazol-5-yl)ethylamino]-1-methyl-butoxy]benzonitrile Formula: C17H21ClN4O MolecularWeight: 332.82784

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCNCCC1=CN=CN1)OC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

CC(CCCNCCC1=CN=CN1)OC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C17H21ClN4O/c1-13(23-17-9-15(18)5-4-14(17)10-19)3-2-7-20-8-6-16-11-21-12-22-16/h4-5,9,11-13,20H,2-3,6-8H2,1H3,(H,21,22)