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Summary

Name:4-(aminomethyl)-~{N}-(pyridin-2-ylmethyl)benzenesulfonamide
Formula:C13 H15 N3 O2 S
Formal charge:0
Molecular weight:277.342 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.64-(aminomethyl)-~{N}-(pyridin-2-ylmethyl)benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C13H15N3O2S/c14-9-11-4-6-13(7-5-11)19(17,18)16-10-12-3-1-2-8-15-12/h1-8,16H,9-10,14H2
InChIKeyInChI1.03XVNHUDOTGRKSHU-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NCc1ccc(cc1)[S](=O)(=O)NCc2ccccn2
SMILESCACTVS3.385NCc1ccc(cc1)[S](=O)(=O)NCc2ccccn2
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccnc(c1)CNS(=O)(=O)c2ccc(cc2)CN
SMILESOpenEye OEToolkits2.0.6c1ccnc(c1)CNS(=O)(=O)c2ccc(cc2)CN