6HW

N-(2',6-dimethyl[1,1'-biphenyl]-3-yl)-1,3-thiazol-2-amine

Created:2016-04-12
Last modified:  2016-05-25

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Chemical Details

Formal Charge0
Atom Count36
Chiral Atom Count0
Bond Count38
Aromatic Bond Count17
2D diagram of 6HW

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Chemical Component Summary

NameN-(2',6-dimethyl[1,1'-biphenyl]-3-yl)-1,3-thiazol-2-amine
Systematic Name (OpenEye OEToolkits)~{N}-[4-methyl-3-(2-methylphenyl)phenyl]-1,3-thiazol-2-amine
FormulaC17 H16 N2 S
Molecular Weight280.387
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Cc1ccccc1c2c(ccc(c2)Nc3nccs3)C
SMILESCACTVS3.385Cc1ccccc1c2cc(Nc3sccn3)ccc2C
SMILESOpenEye OEToolkits2.0.4Cc1ccccc1c2cc(ccc2C)Nc3nccs3
Canonical SMILESCACTVS3.385 Cc1ccccc1c2cc(Nc3sccn3)ccc2C
Canonical SMILESOpenEye OEToolkits2.0.4 Cc1ccccc1c2cc(ccc2C)Nc3nccs3
InChIInChI1.03 InChI=1S/C17H16N2S/c1-12-5-3-4-6-15(12)16-11-14(8-7-13(16)2)19-17-18-9-10-20-17/h3-11H,1-2H3,(H,18,19)
InChIKeyInChI1.03 OZBQQKIXAODXQL-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 119057482
ChEMBL CHEMBL3818591