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4Y0

Summary
Name:3,4-dimethoxy-N-(5-phenyl-1H-pyrazol-3-yl)benzamide
Formula:C18 H17 N3 O3
Formal charge:0
Formula weight:323.346 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.013,4-dimethoxy-N-(5-phenyl-1H-pyrazol-3-yl)benzamide
OpenEye OEToolkits1.9.23,4-dimethoxy-N-(5-phenyl-1H-pyrazol-3-yl)benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(Nc2nnc(c1ccccc1)c2)c3ccc(OC)c(OC)c3
InChIInChI1.03InChI=1S/C18H17N3O3/c1-23-15-9-8-13(10-16(15)24-2)18(22)19-17-11-14(20-21-17)12-6-4-3-5-7-12/h3-11H,1-2H3,(H2,19,20,21,22)
InChIKeyInChI1.03QAZJUVDICQNITG-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc(cc1OC)C(=O)Nc2cc([nH]n2)c3ccccc3
SMILESCACTVS3.385COc1ccc(cc1OC)C(=O)Nc2cc([nH]n2)c3ccccc3
SMILES_CANONICALOpenEye OEToolkits1.9.2COc1ccc(cc1OC)C(=O)Nc2cc([nH]n2)c3ccccc3
SMILESOpenEye OEToolkits1.9.2COc1ccc(cc1OC)C(=O)Nc2cc([nH]n2)c3ccccc3

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PDB entries from 2026-02-04

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