2-fluoranyl-6-[3-imidazol-1-ylpropyl-(2-oxidanyl-3-propan-2-yloxy-propyl)amino]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[3-imidazol-1-ylpropyl-(2-oxidanyl-3-propan-2-yloxy-propyl)amino]benzenecarbonitrile Openeye Name: 2-fluoro-6-[(2-hydroxy-3-isopropoxy-propyl)-(3-imidazol-1-ylpropyl)amino]benzonitrile CAS Name: 2-fluoro-6-[(2-hydroxy-3-propan-2-yloxypropyl)-[3-(1-imidazolyl)propyl]amino]benzonitrile IUPAC Name: 2-fluoro-6-[(2-hydroxy-3-propan-2-yloxypropyl)-(3-imidazol-1-ylpropyl)amino]benzonitrile Traditional Name: 2-fluoro-6-[(2-hydroxy-3-isopropoxy-propyl)-(3-imidazol-1-ylpropyl)amino]benzonitrile Formula: C19H25FN4O2 MolecularWeight: 360.425803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC(CN(CCCN1C=CN=C1)C2=C(C(=CC=C2)F)C#N)O

Isomeric SMILES

CC(C)OCC(CN(CCCN1C=CN=C1)C2=C(C(=CC=C2)F)C#N)O

InChI

InChI=1S/C19H25FN4O2/c1-15(2)26-13-16(25)12-24(9-4-8-23-10-7-22-14-23)19-6-3-5-18(20)17(19)11-21/h3,5-7,10,14-16,25H,4,8-9,12-13H2,1-2H3