1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-phenylsulfanyl-propan-1-one

Systemtic Name: 1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-phenylsulfanyl-propan-1-one Openeye Name: 1-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-2-phenylsulfanyl-propan-1-one CAS Name: 1-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-2-(phenylthio)-1-propanone IUPAC Name: 1-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-2-phenylsulfanylpropan-1-one Traditional Name: 1-[4-(5-bromo-2-pyridyl)piperazino]-2-(phenylthio)propan-1-one Formula: C18H20BrN3OS MolecularWeight: 406.3399

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=NC=C(C=C2)Br)SC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=NC=C(C=C2)Br)SC3=CC=CC=C3

InChI

InChI=1S/C18H20BrN3OS/c1-14(24-16-5-3-2-4-6-16)18(23)22-11-9-21(10-12-22)17-8-7-15(19)13-20-17/h2-8,13-14H,9-12H2,1H3