1-[4-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[[2-(3-bromophenyl)thiazol-4-yl]methyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[[2-(3-bromophenyl)-4-thiazolyl]methyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[[2-(3-bromophenyl)thiazol-4-yl]methyl]piperazino]-2-methyl-propan-1-one Formula: C18H22BrN3OS MolecularWeight: 408.35578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22BrN3OS/c1-13(2)18(23)22-8-6-21(7-9-22)11-16-12-24-17(20-16)14-4-3-5-15(19)10-14/h3-5,10,12-13H,6-9,11H2,1-2H3