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

Systemtic Name: 2-(5-bromanyl-4-methyl-thiophen-2-yl)-4-[[4-(4-imidazol-1-ylbutyl)phenoxy]methyl]-1,3-oxazole Openeye Name: 2-(5-bromo-4-methyl-2-thienyl)-4-[[4-(4-imidazol-1-ylbutyl)phenoxy]methyl]oxazole CAS Name: 2-(5-bromo-4-methyl-2-thiophenyl)-4-[[4-[4-(1-imidazolyl)butyl]phenoxy]methyl]oxazole IUPAC Name: 2-(5-bromo-4-methylthiophen-2-yl)-4-[[4-(4-imidazol-1-ylbutyl)phenoxy]methyl]-1,3-oxazole Traditional Name: 2-(5-bromo-4-methyl-2-thienyl)-4-[[4-(4-imidazol-1-ylbutyl)phenoxy]methyl]oxazole Formula: C22H22BrN3O2S MolecularWeight: 472.39798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C2=NC(=CO2)COC3=CC=C(C=C3)CCCCN4C=CN=C4)Br

Isomeric SMILES

CC1=C(SC(=C1)C2=NC(=CO2)COC3=CC=C(C=C3)CCCCN4C=CN=C4)Br

InChI

InChI=1S/C22H22BrN3O2S/c1-16-12-20(29-21(16)23)22-25-18(14-28-22)13-27-19-7-5-17(6-8-19)4-2-3-10-26-11-9-24-15-26/h5-9,11-12,14-15H,2-4,10,13H2,1H3