5-[[3-(4-imidazol-1-ylbutyl)phenoxy]methyl]-2-thiophen-2-yl-1,3-benzoxazole

Systemtic Name: 5-[[3-(4-imidazol-1-ylbutyl)phenoxy]methyl]-2-thiophen-2-yl-1,3-benzoxazole Openeye Name: 5-[[3-(4-imidazol-1-ylbutyl)phenoxy]methyl]-2-(2-thienyl)-1,3-benzoxazole CAS Name: 5-[[3-[4-(1-imidazolyl)butyl]phenoxy]methyl]-2-thiophen-2-yl-1,3-benzoxazole IUPAC Name: 5-[[3-(4-imidazol-1-ylbutyl)phenoxy]methyl]-2-thiophen-2-yl-1,3-benzoxazole Traditional Name: 5-[[3-(4-imidazol-1-ylbutyl)phenoxy]methyl]-2-(2-thienyl)-1,3-benzoxazole Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=CC3=C(C=C2)OC(=N3)C4=CC=CS4)CCCCN5C=CN=C5

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=CC3=C(C=C2)OC(=N3)C4=CC=CS4)CCCCN5C=CN=C5

InChI

InChI=1S/C25H23N3O2S/c1(2-12-28-13-11-26-18-28)5-19-6-3-7-21(15-19)29-17-20-9-10-23-22(16-20)27-25(30-23)24-8-4-14-31-24/h3-4,6-11,13-16,18H,1-2,5,12,17H2