(2R)-2-(2-methylsulfanyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid

Systemtic Name: (2R)-2-(2-methylsulfanyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: (2R)-2-(2-methylsulfanyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid CAS Name: (2R)-2-[2-(methylthio)-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl]propanoic acid IUPAC Name: (2R)-2-(2-methylsulfanyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: (2R)-2-[4-keto-2-(methylthio)-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C16H14N2O3S2 MolecularWeight: 346.42396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(=O)C2=C(N=C1SC)SC=C2C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)O)N1C(=O)C2=C(N=C1SC)SC=C2C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O3S2/c1-9(15(20)21)18-14(19)12-11(10-6-4-3-5-7-10)8-23-13(12)17-16(18)22-2/h3-9H,1-2H3,(H,20,21)/t9-/m1/s1