1-(3-bromanylthiophen-2-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 1-(3-bromanylthiophen-2-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 1-(3-bromo-2-thienyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 1-(3-bromo-2-thiophenyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 1-(3-bromothiophen-2-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 1-(3-bromo-2-thienyl)-2-[4-(2-pyrimidyl)piperazino]ethanone Formula: C14H15BrN4OS MolecularWeight: 367.2641

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C2=C(C=CS2)Br)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CC(=O)C2=C(C=CS2)Br)C3=NC=CC=N3

InChI

InChI=1S/C14H15BrN4OS/c15-11-2-9-21-13(11)12(20)10-18-5-7-19(8-6-18)14-16-3-1-4-17-14/h1-4,9H,5-8,10H2