4-[1-azanyl-5-[(3-hydroxyphenyl)methoxy]-1-(3-methylimidazol-4-yl)pentyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[1-azanyl-5-[(3-hydroxyphenyl)methoxy]-1-(3-methylimidazol-4-yl)pentyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[1-amino-5-[(3-hydroxyphenyl)methoxy]-1-(3-methylimidazol-4-yl)pentyl]-2-fluoro-benzonitrile CAS Name: 4-[1-amino-5-[(3-hydroxyphenyl)methoxy]-1-(3-methyl-4-imidazolyl)pentyl]-2-fluorobenzonitrile IUPAC Name: 4-[1-amino-5-[(3-hydroxyphenyl)methoxy]-1-(3-methylimidazol-4-yl)pentyl]-2-fluorobenzonitrile Traditional Name: 4-[1-amino-5-(3-hydroxybenzyl)oxy-1-(3-methylimidazol-4-yl)pentyl]-2-fluoro-benzonitrile Formula: C23H25FN4O2 MolecularWeight: 408.468603

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(CCCCOCC2=CC(=CC=C2)O)(C3=CC(=C(C=C3)C#N)F)N

Isomeric SMILES

CN1C=NC=C1C(CCCCOCC2=CC(=CC=C2)O)(C3=CC(=C(C=C3)C#N)F)N

InChI

InChI=1S/C23H25FN4O2/c1-28-16-27-14-22(28)23(26,19-8-7-18(13-25)21(24)12-19)9-2-3-10-30-15-17-5-4-6-20(29)11-17/h4-8,11-12,14,16,29H,2-3,9-10,15,26H2,1H3