3-(2-bromophenyl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(2-bromophenyl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(2-bromophenyl)sulfanyl-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-[(2-bromophenyl)thio]-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(2-bromophenyl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[(2-bromophenyl)thio]-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C18H20BrN3OS MolecularWeight: 406.3399

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CCSC3=CC=CC=C3Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CCSC3=CC=CC=C3Br

InChI

InChI=1S/C18H20BrN3OS/c19-15-5-1-2-6-16(15)24-14-8-18(23)22-12-10-21(11-13-22)17-7-3-4-9-20-17/h1-7,9H,8,10-14H2