2-(4-bromanylphenoxy)-1-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 2-(4-bromophenoxy)-1-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propan-1-one CAS Name: 2-(4-bromophenoxy)-1-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 2-(4-bromophenoxy)-1-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]propan-1-one Formula: C20H21BrN4O3S MolecularWeight: 477.37474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=NC(=NO2)C3=CC=CS3)OC4=CC=C(C=C4)Br

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=NC(=NO2)C3=CC=CS3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H21BrN4O3S/c1-14(27-16-6-4-15(21)5-7-16)20(26)25-10-8-24(9-11-25)13-18-22-19(23-28-18)17-3-2-12-29-17/h2-7,12,14H,8-11,13H2,1H3