(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide

Systemtic Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide Openeye Name: (2S)-N-(5-methylisoxazol-3-yl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide CAS Name: (2S)-N-(5-methyl-3-isoxazolyl)-2-(4-thieno[2,3-d]pyrimidinylthio)propanamide IUPAC Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanamide Traditional Name: (2S)-N-(5-methylisoxazol-3-yl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)propionamide Formula: C13H12N4O2S2 MolecularWeight: 320.38998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SC2=NC=NC3=C2C=CS3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C)SC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C13H12N4O2S2/c1-7-5-10(17-19-7)16-11(18)8(2)21-13-9-3-4-20-12(9)14-6-15-13/h3-6,8H,1-2H3,(H,16,17,18)/t8-/m0/s1