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EFU

Summary
Name:N-benzyl-6-hydroxy-N-methyl-3-(3-methylbenzyl)-1H-indazole-5-carboxamide
Formula:C24 H23 N3 O2
Formal charge:0
Formula weight:385.458 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-benzyl-6-hydroxy-N-methyl-3-(3-methylbenzyl)-1H-indazole-5-carboxamide
OpenEye OEToolkits1.7.6N-methyl-3-[(3-methylphenyl)methyl]-6-oxidanyl-N-(phenylmethyl)-1H-indazole-5-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(c1cc2c(cc1O)nnc2Cc3cccc(c3)C)N(Cc4ccccc4)C
InChIInChI1.03InChI=1S/C24H23N3O2/c1-16-7-6-10-18(11-16)12-21-19-13-20(23(28)14-22(19)26-25-21)24(29)27(2)15-17-8-4-3-5-9-17/h3-11,13-14,28H,12,15H2,1-2H3,(H,25,26)
InChIKeyInChI1.03JTCGRDMMRLTULM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370CN(Cc1ccccc1)C(=O)c2cc3c(Cc4cccc(C)c4)n[nH]c3cc2O
SMILESCACTVS3.370CN(Cc1ccccc1)C(=O)c2cc3c(Cc4cccc(C)c4)n[nH]c3cc2O
SMILES_CANONICALOpenEye OEToolkits1.7.6Cc1cccc(c1)Cc2c3cc(c(cc3[nH]n2)O)C(=O)N(C)Cc4ccccc4
SMILESOpenEye OEToolkits1.7.6Cc1cccc(c1)Cc2c3cc(c(cc3[nH]n2)O)C(=O)N(C)Cc4ccccc4

218853

PDB entries from 2024-04-24

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