5-(azepan-1-yl)-2-[5-[(3-methylphenoxy)methyl]furan-2-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(azepan-1-yl)-2-[5-[(3-methylphenoxy)methyl]furan-2-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(azepan-1-yl)-2-[5-[(3-methylphenoxy)methyl]-2-furyl]oxazole-4-carbonitrile CAS Name: 5-(1-azepanyl)-2-[5-[(3-methylphenoxy)methyl]-2-furanyl]-4-oxazolecarbonitrile IUPAC Name: 5-(azepan-1-yl)-2-[5-[(3-methylphenoxy)methyl]furan-2-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(azepan-1-yl)-2-[5-[(3-methylphenoxy)methyl]-2-furyl]oxazole-4-carbonitrile Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=CC=C(O2)C3=NC(=C(O3)N4CCCCCC4)C#N

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=CC=C(O2)C3=NC(=C(O3)N4CCCCCC4)C#N

InChI

InChI=1S/C22H23N3O3/c1-16-7-6-8-17(13-16)26-15-18-9-10-20(27-18)21-24-19(14-23)22(28-21)25-11-4-2-3-5-12-25/h6-10,13H,2-5,11-12,15H2,1H3