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

Systemtic Name: 2-(5-bromanyl-4-methyl-thiophen-2-yl)-4-[[4-(3-imidazol-1-ylpropyl)phenoxy]methyl]-1,3-oxazole Openeye Name: 2-(5-bromo-4-methyl-2-thienyl)-4-[[4-(3-imidazol-1-ylpropyl)phenoxy]methyl]oxazole CAS Name: 2-(5-bromo-4-methyl-2-thiophenyl)-4-[[4-[3-(1-imidazolyl)propyl]phenoxy]methyl]oxazole IUPAC Name: 2-(5-bromo-4-methylthiophen-2-yl)-4-[[4-(3-imidazol-1-ylpropyl)phenoxy]methyl]-1,3-oxazole Traditional Name: 2-(5-bromo-4-methyl-2-thienyl)-4-[[4-(3-imidazol-1-ylpropyl)phenoxy]methyl]oxazole Formula: C21H20BrN3O2S MolecularWeight: 458.3714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C2=NC(=CO2)COC3=CC=C(C=C3)CCCN4C=CN=C4)Br

Isomeric SMILES

CC1=C(SC(=C1)C2=NC(=CO2)COC3=CC=C(C=C3)CCCN4C=CN=C4)Br

InChI

InChI=1S/C21H20BrN3O2S/c1-15-11-19(28-20(15)22)21-24-17(13-27-21)12-26-18-6-4-16(5-7-18)3-2-9-25-10-8-23-14-25/h4-8,10-11,13-14H,2-3,9,12H2,1H3