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GP6

Summary
Name:1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA
Formula:C14 H13 Cl N4 O
Formal charge:0
Formula weight:288.732 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.044-{[(4-chlorophenyl)carbamoyl]amino}benzenecarboximidamide
OpenEye OEToolkits1.5.01-(4-carbamimidoylphenyl)-3-(4-chlorophenyl)urea

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Clc2ccc(NC(=O)Nc1ccc(C(=[N@H])N)cc1)cc2
SMILES_CANONICALCACTVS3.341NC(=N)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
SMILESCACTVS3.341NC(=N)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
SMILES_CANONICALOpenEye OEToolkits1.5.0[H]/N=C(\c1ccc(cc1)NC(=O)Nc2ccc(cc2)Cl)/N
SMILESOpenEye OEToolkits1.5.0[H]N=C(c1ccc(cc1)NC(=O)Nc2ccc(cc2)Cl)N
InChIInChI1.03InChI=1S/C14H13ClN4O/c15-10-3-7-12(8-4-10)19-14(20)18-11-5-1-9(2-6-11)13(16)17/h1-8H,(H3,16,17)(H2,18,19,20)
InChIKeyInChI1.03HQWKMDKTTCPCMQ-UHFFFAOYSA-N

222415

數據於2024-07-10公開中

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