N-[2-oxidanyl-5-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoyl)phenyl]ethanamide

Systemtic Name: N-[2-oxidanyl-5-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoyl)phenyl]ethanamide Openeye Name: N-[2-hydroxy-5-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)phenyl]acetamide CAS Name: N-[2-hydroxy-5-[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]phenyl]acetamide IUPAC Name: N-[2-hydroxy-5-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)phenyl]acetamide Traditional Name: N-[2-hydroxy-5-[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]phenyl]acetamide Formula: C16H13N3O3S2 MolecularWeight: 359.42272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)CSC2=NC=NC3=C2C=CS3)O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)CSC2=NC=NC3=C2C=CS3)O

InChI

InChI=1S/C16H13N3O3S2/c1-9(20)19-12-6-10(2-3-13(12)21)14(22)7-24-16-11-4-5-23-15(11)17-8-18-16/h2-6,8,21H,7H2,1H3,(H,19,20)