57N

(2R)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenyl-N-(1,3-thiazol-2-yl)acetamide

Created:2015-08-10
Last modified:  2016-06-08

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Chemical Details

Formal Charge0
Atom Count40
Chiral Atom Count1
Bond Count43
Aromatic Bond Count17
2D diagram of 57N

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Chemical Component Summary

Name(2R)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenyl-N-(1,3-thiazol-2-yl)acetamide
Systematic Name (OpenEye OEToolkits)(2R)-2-(3-oxidanylidene-1H-isoindol-2-yl)-2-phenyl-N-(1,3-thiazol-2-yl)ethanamide
FormulaC19 H15 N3 O2 S
Molecular Weight349.406
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1(nccs1)NC(C(c2ccccc2)N4C(c3ccccc3C4)=O)=O
SMILESCACTVS3.385O=C(Nc1sccn1)[CH](N2Cc3ccccc3C2=O)c4ccccc4
SMILESOpenEye OEToolkits1.9.2c1ccc(cc1)C(C(=O)Nc2nccs2)N3Cc4ccccc4C3=O
Canonical SMILESCACTVS3.385 O=C(Nc1sccn1)[C@H](N2Cc3ccccc3C2=O)c4ccccc4
Canonical SMILESOpenEye OEToolkits1.9.2 c1ccc(cc1)[C@H](C(=O)Nc2nccs2)N3Cc4ccccc4C3=O
InChIInChI1.03 InChI=1S/C19H15N3O2S/c23-17(21-19-20-10-11-25-19)16(13-6-2-1-3-7-13)22-12-14-8-4-5-9-15(14)18(22)24/h1-11,16H,12H2,(H,20,21,23)/t16-/m1/s1
InChIKeyInChI1.03 PWRVRDCBFYLYFU-MRXNPFEDSA-N

Related Resource References

Resource NameReference
PubChem 51607467