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H38

Summary
Name:N,N'-biphenyl-3,3'-diyldithiophene-2-carboximidamide
Formula:C22 H18 N4 S2
Formal charge:0
Formula weight:402.535 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N,N'-biphenyl-3,3'-diyldithiophene-2-carboximidamide
OpenEye OEToolkits1.7.6N-[3-[3-[(C-thiophen-2-ylcarbonimidoyl)amino]phenyl]phenyl]thiophene-2-carboximidamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01s1cccc1C(=[N@H])Nc2cccc(c2)c3cc(ccc3)NC(=[N@H])c4sccc4
InChIInChI1.03InChI=1S/C22H18N4S2/c23-21(19-9-3-11-27-19)25-17-7-1-5-15(13-17)16-6-2-8-18(14-16)26-22(24)20-10-4-12-28-20/h1-14H,(H2,23,25)(H2,24,26)
InChIKeyInChI1.03ACHJMDNIBGAZJH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370N=C(Nc1cccc(c1)c2cccc(NC(=N)c3sccc3)c2)c4sccc4
SMILESCACTVS3.370N=C(Nc1cccc(c1)c2cccc(NC(=N)c3sccc3)c2)c4sccc4
SMILES_CANONICALOpenEye OEToolkits1.7.6[H]/N=C(\Nc1cc(ccc1)c2cc(ccc2)N/C(=N/[H])/c3sccc3)/c4sccc4
SMILESOpenEye OEToolkits1.7.6c1cc(cc(c1)NC(=N)c2cccs2)c3cccc(c3)NC(=N)c4cccs4

222415

數據於2024-07-10公開中

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