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7II

概要
表記:Sulfoxaflor
別名:[methyl-oxidanylidene-[1-[6-(trifluoromethyl)pyridin-3-yl]ethyl]-$l^{6}-sulfanylidene]cyanamide
組成式:C10 H10 F3 N3 O S
電荷:0
化学式量:277.266 Da
分子種別:non-polymer

化合物名

プログラムバージョン表記
OpenEye OEToolkits2.0.7[methyl-oxidanylidene-[1-[6-(trifluoromethyl)pyridin-3-yl]ethyl]-$l^{6}-sulfanylidene]cyanamide

化合物記述子(線形表記)

種別プログラムバージョン表記
InChIInChI1.03InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3/t7-,18+/m0/s1
InChIKeyInChI1.03ZVQOOHYFBIDMTQ-ULCDLSAGSA-N
SMILES_CANONICALCACTVS3.385C[C@@H](c1ccc(nc1)C(F)(F)F)[S@@](C)(=O)=NC#N
SMILESCACTVS3.385C[CH](c1ccc(nc1)C(F)(F)F)[S](C)(=O)=NC#N
SMILES_CANONICALOpenEye OEToolkits2.0.7CC(c1ccc(nc1)C(F)(F)F)[S@](=NC#N)(=O)C
SMILESOpenEye OEToolkits2.0.7CC(c1ccc(nc1)C(F)(F)F)S(=NC#N)(=O)C

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件を2024-07-10に公開中

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