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PHU

Summary
Name:1-phenylurea
Synonyms:Phenylurea
Formula:C7 H8 N2 O
Formal charge:0
Formula weight:136.151 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.011-phenylurea
OpenEye OEToolkits1.7.21-phenylurea

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(Nc1ccccc1)N
InChIInChI1.03InChI=1S/C7H8N2O/c8-7(10)9-6-4-2-1-3-5-6/h1-5H,(H3,8,9,10)
InChIKeyInChI1.03LUBJCRLGQSPQNN-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370NC(=O)Nc1ccccc1
SMILESCACTVS3.370NC(=O)Nc1ccccc1
SMILES_CANONICALOpenEye OEToolkits1.7.2c1ccc(cc1)NC(=O)N
SMILESOpenEye OEToolkits1.7.2c1ccc(cc1)NC(=O)N

221051

PDB entries from 2024-06-12

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