1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-3-(5-phenylfuran-2-yl)propan-1-one

Systemtic Name: 1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-3-(5-phenylfuran-2-yl)propan-1-one Openeye Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-(5-phenyl-2-furyl)propan-1-one CAS Name: 1-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-3-(5-phenyl-2-furanyl)-1-propanone IUPAC Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-(5-phenylfuran-2-yl)propan-1-one Traditional Name: 1-[4-(5-bromopyrimidin-2-yl)piperazino]-3-(5-phenyl-2-furyl)propan-1-one Formula: C21H21BrN4O2 MolecularWeight: 441.32104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)CCC3=CC=C(O3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)CCC3=CC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C21H21BrN4O2/c22-17-14-23-21(24-15-17)26-12-10-25(11-13-26)20(27)9-7-18-6-8-19(28-18)16-4-2-1-3-5-16/h1-6,8,14-15H,7,9-13H2