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I5H

Summary
Name:(5S)-5-(1H-indol-3-ylmethyl)imidazolidine-2,4-dione
Formula:C12 H11 N3 O2
Formal charge:0
Formula weight:229.235 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(5S)-5-(1H-indol-3-ylmethyl)imidazolidine-2,4-dione
OpenEye OEToolkits1.7.6(5S)-5-(1H-indol-3-ylmethyl)imidazolidine-2,4-dione

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C1NC(=O)C(N1)Cc2cnc3ccccc23
InChIInChI1.03InChI=1S/C12H11N3O2/c16-11-10(14-12(17)15-11)5-7-6-13-9-4-2-1-3-8(7)9/h1-4,6,10,13H,5H2,(H2,14,15,16,17)/t10-/m0/s1
InChIKeyInChI1.03RUUREKIGAKIKIL-JTQLQIEISA-N
SMILES_CANONICALCACTVS3.385O=C1N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1
SMILESCACTVS3.385O=C1N[CH](Cc2c[nH]c3ccccc23)C(=O)N1
SMILES_CANONICALOpenEye OEToolkits1.7.6c1ccc2c(c1)c(c[nH]2)C[C@H]3C(=O)NC(=O)N3
SMILESOpenEye OEToolkits1.7.6c1ccc2c(c1)c(c[nH]2)CC3C(=O)NC(=O)N3

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PDB entries from 2024-11-06

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