1-[4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]carbonyl-2-methyl-piperazin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethyl-pyrazol-4-yl]carbonyl-2-methyl-piperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carbonyl]-2-methyl-piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-[[1-[4-(4-bromophenyl)-2-thiazolyl]-5-ethyl-4-pyrazolyl]-oxomethyl]-2-methyl-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-ethylpyrazole-4-carbonyl]-2-methylpiperazin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-ethyl-pyrazole-4-carbonyl]-2-methyl-piperazino]-2-phenoxy-ethanone Formula: C28H28BrN5O3S MolecularWeight: 594.52262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Br)C(=O)N4CCN(C(C4)C)C(=O)COC5=CC=CC=C5

Isomeric SMILES

CCC1=C(C=NN1C2=NC(=CS2)C3=CC=C(C=C3)Br)C(=O)N4CCN(C(C4)C)C(=O)COC5=CC=CC=C5

InChI

InChI=1S/C28H28BrN5O3S/c1-3-25-23(15-30-34(25)28-31-24(18-38-28)20-9-11-21(29)12-10-20)27(36)32-13-14-33(19(2)16-32)26(35)17-37-22-7-5-4-6-8-22/h4-12,15,18-19H,3,13-14,16-17H2,1-2H3