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EAW

Summary
Name:N-(2-bromophenyl)pyrrolidine-1-sulfonamide
Formula:C10 H13 Br N2 O2 S
Formal charge:0
Formula weight:305.191 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6~{N}-(2-bromophenyl)pyrrolidine-1-sulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H13BrN2O2S/c11-9-5-1-2-6-10(9)12-16(14,15)13-7-3-4-8-13/h1-2,5-6,12H,3-4,7-8H2
InChIKeyInChI1.03SKZKXVWQIHWABR-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Brc1ccccc1N[S](=O)(=O)N2CCCC2
SMILESCACTVS3.385Brc1ccccc1N[S](=O)(=O)N2CCCC2
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccc(c(c1)NS(=O)(=O)N2CCCC2)Br
SMILESOpenEye OEToolkits2.0.6c1ccc(c(c1)NS(=O)(=O)N2CCCC2)Br

227344

数据于2024-11-13公开中

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