C3Z

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Summary

Name:3-(phenylmethyl)-5-(2-phenylpyrazol-3-yl)-2~{H}-indazol-6-ol
Formula:C23 H18 N4 O
Formal charge:0
Molecular weight:366.415 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.63-(phenylmethyl)-5-(2-phenylpyrazol-3-yl)-2~{H}-indazol-6-ol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C23H18N4O/c28-23-15-21-18(20(25-26-21)13-16-7-3-1-4-8-16)14-19(23)22-11-12-24-27(22)17-9-5-2-6-10-17/h1-12,14-15,28H,13H2,(H,25,26)
InChIKeyInChI1.03XBGRZWVCOXMUCW-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1cc2n[nH]c(Cc3ccccc3)c2cc1c4ccnn4c5ccccc5
SMILESCACTVS3.385Oc1cc2n[nH]c(Cc3ccccc3)c2cc1c4ccnn4c5ccccc5
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccc(cc1)Cc2c3cc(c(cc3n[nH]2)O)c4ccnn4c5ccccc5
SMILESOpenEye OEToolkits2.0.6c1ccc(cc1)Cc2c3cc(c(cc3n[nH]2)O)c4ccnn4c5ccccc5