MMJ

N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine

Created:2012-03-29
Last modified:  2013-01-25

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Chemical Details

Formal Charge0
Atom Count29
Chiral Atom Count0
Bond Count30
Aromatic Bond Count11
2D diagram of MMJ

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Chemical Component Summary

NameN-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine
Systematic Name (OpenEye OEToolkits)N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine
FormulaC12 H14 N2 S
Molecular Weight218.318
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01n1c(c(sc1c2ccccc2)CNC)C
SMILESCACTVS3.370CNCc1sc(nc1C)c2ccccc2
SMILESOpenEye OEToolkits1.7.6Cc1c(sc(n1)c2ccccc2)CNC
Canonical SMILESCACTVS3.370 CNCc1sc(nc1C)c2ccccc2
Canonical SMILESOpenEye OEToolkits1.7.6 Cc1c(sc(n1)c2ccccc2)CNC
InChIInChI1.03 InChI=1S/C12H14N2S/c1-9-11(8-13-2)15-12(14-9)10-6-4-3-5-7-10/h3-7,13H,8H2,1-2H3
InChIKeyInChI1.03 GFAGRBRYZWAUSV-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 4961253