(2S)-N-(propan-2-ylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide

Systemtic Name: (2S)-N-(propan-2-ylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide Openeye Name: (2S)-N-(isopropylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide CAS Name: (2S)-N-[oxo-(propan-2-ylamino)methyl]-2-(4-thieno[2,3-d]pyrimidinylthio)propanamide IUPAC Name: (2S)-N-(propan-2-ylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanamide Traditional Name: (2S)-N-(isopropylcarbamoyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)propionamide Formula: C13H16N4O2S2 MolecularWeight: 324.42174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)SC1=NC=NC2=C1C=CS2

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)C)SC1=NC=NC2=C1C=CS2

InChI

InChI=1S/C13H16N4O2S2/c1-7(2)16-13(19)17-10(18)8(3)21-12-9-4-5-20-11(9)14-6-15-12/h4-8H,1-3H3,(H2,16,17,18,19)/t8-/m0/s1