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F6B

概要
表記:N-(2,6-DIFLUORO-BENZYL)-4-SULFAMOYL-BENZAMIDE
組成式:C14 H12 F2 N2 O3 S
電荷:0
化学式量:326.318 Da
分子種別:NON-POLYMER

化合物名

プログラムバージョン表記
ACDLabs12.01N-[(2,6-difluorophenyl)methyl]-4-sulfamoylbenzamide
OpenEye OEToolkits1.7.6N-[[2,6-bis(fluoranyl)phenyl]methyl]-4-sulfamoyl-benzamide

化合物記述子(線形表記)

種別プログラムバージョン表記
SMILESACDLabs12.01c1cc(ccc1C(=O)NCc2c(cccc2F)F)S(N)(=O)=O
InChIInChI1.03InChI=1S/C14H12F2N2O3S/c15-12-2-1-3-13(16)11(12)8-18-14(19)9-4-6-10(7-5-9)22(17,20)21/h1-7H,8H2,(H,18,19)(H2,17,20,21)
InChIKeyInChI1.03ZFNCKGXGCCDDFN-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385N[S](=O)(=O)c1ccc(cc1)C(=O)NCc2c(F)cccc2F
SMILESCACTVS3.385N[S](=O)(=O)c1ccc(cc1)C(=O)NCc2c(F)cccc2F
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc(c(c(c1)F)CNC(=O)c2ccc(cc2)S(=O)(=O)N)F
SMILESOpenEye OEToolkits1.7.6c1cc(c(c(c1)F)CNC(=O)c2ccc(cc2)S(=O)(=O)N)F

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件を2024-07-17に公開中

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