1-[4-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl]piperazino]ethanone Formula: C17H20BrN3O2S MolecularWeight: 410.3286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=CSC(=N2)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=CSC(=N2)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C17H20BrN3O2S/c1-12(22)21-7-5-20(6-8-21)10-14-11-24-17(19-14)15-9-13(18)3-4-16(15)23-2/h3-4,9,11H,5-8,10H2,1-2H3