1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-3-(2,4-dimethylphenyl)propan-1-one

Systemtic Name: 1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-3-(2,4-dimethylphenyl)propan-1-one Openeye Name: 1-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-3-(2,4-dimethylphenyl)propan-1-one CAS Name: 1-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-3-(2,4-dimethylphenyl)-1-propanone IUPAC Name: 1-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-3-(2,4-dimethylphenyl)propan-1-one Traditional Name: 1-[4-(5-bromo-2-pyridyl)piperazino]-3-(2,4-dimethylphenyl)propan-1-one Formula: C20H24BrN3O MolecularWeight: 402.32806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24BrN3O/c1-15-3-4-17(16(2)13-15)5-8-20(25)24-11-9-23(10-12-24)19-7-6-18(21)14-22-19/h3-4,6-7,13-14H,5,8-12H2,1-2H3