2-[(3-bromanylphenoxy)methyl]-5-(3-imidazol-1-ylpropylamino)-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-[(3-bromanylphenoxy)methyl]-5-(3-imidazol-1-ylpropylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(3-bromophenoxy)methyl]-5-(3-imidazol-1-ylpropylamino)oxazole-4-carbonitrile CAS Name: 2-[(3-bromophenoxy)methyl]-5-[3-(1-imidazolyl)propylamino]-4-oxazolecarbonitrile IUPAC Name: 2-[(3-bromophenoxy)methyl]-5-(3-imidazol-1-ylpropylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(3-bromophenoxy)methyl]-5-(3-imidazol-1-ylpropylamino)oxazole-4-carbonitrile Formula: C17H16BrN5O2 MolecularWeight: 402.24524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCC2=NC(=C(O2)NCCCN3C=CN=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCC2=NC(=C(O2)NCCCN3C=CN=C3)C#N

InChI

InChI=1S/C17H16BrN5O2/c18-13-3-1-4-14(9-13)24-11-16-22-15(10-19)17(25-16)21-5-2-7-23-8-6-20-12-23/h1,3-4,6,8-9,12,21H,2,5,7,11H2