2-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1H-imidazole-5-carbonitrile

Systemtic Name: 2-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1H-imidazole-5-carbonitrile Openeye Name: 2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1H-imidazole-5-carbonitrile CAS Name: 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-imidazole-5-carbonitrile IUPAC Name: 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-imidazole-5-carbonitrile Traditional Name: 2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1H-imidazole-5-carbonitrile Formula: C17H22N4O2 MolecularWeight: 314.38218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=C(C=C1)C2=NC=C(N2)C#N)O

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=C(C=C1)C2=NC=C(N2)C#N)O

InChI

InChI=1S/C17H22N4O2/c1-17(2,3)20-10-14(22)11-23-15-6-4-12(5-7-15)16-19-9-13(8-18)21-16/h4-7,9,14,20,22H,10-11H2,1-3H3,(H,19,21)