4-(5-bromanylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(5-bromanylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 4-(5-bromo-2-thienyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one CAS Name: 4-(5-bromo-2-thiophenyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(5-bromothiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 4-(5-bromo-2-thienyl)-1-[4-(2-pyrimidyl)piperazino]butan-1-one Formula: C16H19BrN4OS MolecularWeight: 395.31726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCC3=CC=C(S3)Br

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCC3=CC=C(S3)Br

InChI

InChI=1S/C16H19BrN4OS/c17-14-6-5-13(23-14)3-1-4-15(22)20-9-11-21(12-10-20)16-18-7-2-8-19-16/h2,5-8H,1,3-4,9-12H2