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JTS

Summary
Name:4-methyl-N-(naphthalen-2-yl)-1,3-thiazole-5-carboxamide
Formula:C15 H12 N2 O S
Formal charge:0
Formula weight:268.334 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-methyl-N-(naphthalen-2-yl)-1,3-thiazole-5-carboxamide
OpenEye OEToolkits1.7.64-methyl-N-naphthalen-2-yl-1,3-thiazole-5-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(Nc2cc1ccccc1cc2)c3scnc3C
InChIInChI1.03InChI=1S/C15H12N2OS/c1-10-14(19-9-16-10)15(18)17-13-7-6-11-4-2-3-5-12(11)8-13/h2-9H,1H3,(H,17,18)
InChIKeyInChI1.03UZLLQPJAEOJDCI-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370Cc1ncsc1C(=O)Nc2ccc3ccccc3c2
SMILESCACTVS3.370Cc1ncsc1C(=O)Nc2ccc3ccccc3c2
SMILES_CANONICALOpenEye OEToolkits1.7.6Cc1c(scn1)C(=O)Nc2ccc3ccccc3c2
SMILESOpenEye OEToolkits1.7.6Cc1c(scn1)C(=O)Nc2ccc3ccccc3c2

225158

PDB entries from 2024-09-18

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