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BEX

Summary
Name:N-[(R)-[(3,4-dimethoxyphenyl)amino](phenoxy)methyl]sulfamide
Formula:C15 H19 N3 O5 S
Formal charge:0
Formula weight:353.393 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-[(R)-[(3,4-dimethoxyphenyl)amino](phenoxy)methyl]sulfuric diamide
OpenEye OEToolkits1.7.01,2-dimethoxy-4-[[(R)-phenoxy-(sulfamoylamino)methyl]amino]benzene

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=S(=O)(N)NC(Oc1ccccc1)Nc2cc(OC)c(OC)cc2
SMILES_CANONICALCACTVS3.370COc1ccc(N[C@H](N[S](N)(=O)=O)Oc2ccccc2)cc1OC
SMILESCACTVS3.370COc1ccc(N[CH](N[S](N)(=O)=O)Oc2ccccc2)cc1OC
SMILES_CANONICALOpenEye OEToolkits1.7.0COc1ccc(cc1OC)N[C@H](NS(=O)(=O)N)Oc2ccccc2
SMILESOpenEye OEToolkits1.7.0COc1ccc(cc1OC)NC(NS(=O)(=O)N)Oc2ccccc2
InChIInChI1.03InChI=1S/C15H19N3O5S/c1-21-13-9-8-11(10-14(13)22-2)17-15(18-24(16,19)20)23-12-6-4-3-5-7-12/h3-10,15,17-18H,1-2H3,(H2,16,19,20)/t15-/m1/s1
InChIKeyInChI1.03YJTSCHAMOBJRMX-OAHLLOKOSA-N

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PDB entries from 2024-08-07

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