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1YV

Summary
Name:N-[(2R)-2-(4'-cyanobiphenyl-4-yl)propyl]propane-2-sulfonamide
Formula:C19 H22 N2 O2 S
Formal charge:0
Formula weight:342.455 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-[(2R)-2-(4'-cyanobiphenyl-4-yl)propyl]propane-2-sulfonamide
OpenEye OEToolkits1.7.6N-[(2R)-2-[4-(4-cyanophenyl)phenyl]propyl]propane-2-sulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01N#Cc2ccc(c1ccc(cc1)C(CNS(=O)(=O)C(C)C)C)cc2
InChIInChI1.03InChI=1S/C19H22N2O2S/c1-14(2)24(22,23)21-13-15(3)17-8-10-19(11-9-17)18-6-4-16(12-20)5-7-18/h4-11,14-15,21H,13H2,1-3H3/t15-/m0/s1
InChIKeyInChI1.03HOQAVGZLYRYHSO-HNNXBMFYSA-N
SMILES_CANONICALCACTVS3.385CC(C)[S](=O)(=O)NC[C@H](C)c1ccc(cc1)c2ccc(cc2)C#N
SMILESCACTVS3.385CC(C)[S](=O)(=O)NC[CH](C)c1ccc(cc1)c2ccc(cc2)C#N
SMILES_CANONICALOpenEye OEToolkits1.7.6C[C@@H](CNS(=O)(=O)C(C)C)c1ccc(cc1)c2ccc(cc2)C#N
SMILESOpenEye OEToolkits1.7.6CC(C)S(=O)(=O)NCC(C)c1ccc(cc1)c2ccc(cc2)C#N

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건을2024-07-10부터공개중

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