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

Systemtic Name: 1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-3-(3-methoxyphenyl)propan-1-one Openeye Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-(3-methoxyphenyl)propan-1-one CAS Name: 1-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-3-(3-methoxyphenyl)-1-propanone IUPAC Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-(3-methoxyphenyl)propan-1-one Traditional Name: 1-[4-(5-bromopyrimidin-2-yl)piperazino]-3-(3-methoxyphenyl)propan-1-one Formula: C18H21BrN4O2 MolecularWeight: 405.28894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCC(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

Isomeric SMILES

COC1=CC=CC(=C1)CCC(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

InChI

InChI=1S/C18H21BrN4O2/c1-25-16-4-2-3-14(11-16)5-6-17(24)22-7-9-23(10-8-22)18-20-12-15(19)13-21-18/h2-4,11-13H,5-10H2,1H3