2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-N-(4-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-N-(4-methylsulfanylphenyl)ethanamide Openeye Name: 2-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-N-(4-methylsulfanylphenyl)acetamide CAS Name: 2-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-N-[4-(methylthio)phenyl]acetamide IUPAC Name: 2-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-N-(4-methylsulfanylphenyl)acetamide Traditional Name: 2-[4-(5-bromo-2-pyridyl)piperazino]-N-[4-(methylthio)phenyl]acetamide Formula: C18H21BrN4OS MolecularWeight: 421.35454

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C3=NC=C(C=C3)Br

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C3=NC=C(C=C3)Br

InChI

InChI=1S/C18H21BrN4OS/c1-25-16-5-3-15(4-6-16)21-18(24)13-22-8-10-23(11-9-22)17-7-2-14(19)12-20-17/h2-7,12H,8-11,13H2,1H3,(H,21,24)