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2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile
2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=NC(=C1C#N)SCC2=CC3=C(C=C2Br)OCO3)C
Isomeric SMILES
CC1=CC(=NC(=C1C#N)SCC2=CC3=C(C=C2Br)OCO3)C
InChI
InChI=1S/C16H13BrN2O2S/c1-9-3-10(2)19-16(12(9)6-18)22-7-11-4-14-15(5-13(11)17)21-8-20-14/h3-5H,7-8H2,1-2H3
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