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U6X

Summary
Name:Levosulpiride
Synonyms:~{N}-[[(2~{S})-1-ethylpyrrolidin-2-yl]methyl]-2-methoxy-5-sulfamoyl-benzamide
Formula:C15 H23 N3 O4 S
Formal charge:0
Formula weight:341.426 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-[[(2~{S})-1-ethylpyrrolidin-2-yl]methyl]-2-methoxy-5-sulfamoyl-benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)/t11-/m0/s1
InChIKeyInChI1.06BGRJTUBHPOOWDU-NSHDSACASA-N
SMILES_CANONICALCACTVS3.385CCN1CCC[C@H]1CNC(=O)c2cc(ccc2OC)[S](N)(=O)=O
SMILESCACTVS3.385CCN1CCC[CH]1CNC(=O)c2cc(ccc2OC)[S](N)(=O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7CCN1CCC[C@H]1CNC(=O)c2cc(ccc2OC)S(=O)(=O)N
SMILESOpenEye OEToolkits2.0.7CCN1CCCC1CNC(=O)c2cc(ccc2OC)S(=O)(=O)N

221051

PDB entries from 2024-06-12

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