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8ZM

Summary
Name:5-phenyltetrazolo[1,5-a]pyrimidin-7-ol
Formula:C10 H7 N5 O
Formal charge:0
Formula weight:213.195 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.015-phenyltetrazolo[1,5-a]pyrimidin-7-ol
OpenEye OEToolkits2.0.65-phenyl-[1,2,3,4]tetrazolo[1,5-a]pyrimidin-7-ol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c3(c1nc2n(c(c1)O)nnn2)ccccc3
InChIInChI1.03InChI=1S/C10H7N5O/c16-9-6-8(7-4-2-1-3-5-7)11-10-12-13-14-15(9)10/h1-6,16H
InChIKeyInChI1.03ZEMGYOQXYFNSGE-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1cc(nc2nnnn12)c3ccccc3
SMILESCACTVS3.385Oc1cc(nc2nnnn12)c3ccccc3
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccc(cc1)c2cc(n3c(n2)nnn3)O
SMILESOpenEye OEToolkits2.0.6c1ccc(cc1)c2cc(n3c(n2)nnn3)O

223532

건을2024-08-07부터공개중

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