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

Systemtic Name: 1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-3-(4-methylphenyl)propan-1-one Openeye Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-(p-tolyl)propan-1-one CAS Name: 1-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-3-(4-methylphenyl)-1-propanone IUPAC Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-(4-methylphenyl)propan-1-one Traditional Name: 1-[4-(5-bromopyrimidin-2-yl)piperazino]-3-(p-tolyl)propan-1-one Formula: C18H21BrN4O MolecularWeight: 389.28954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

InChI

InChI=1S/C18H21BrN4O/c1-14-2-4-15(5-3-14)6-7-17(24)22-8-10-23(11-9-22)18-20-12-16(19)13-21-18/h2-5,12-13H,6-11H2,1H3