2-(6-methyl-2-methylsulfanyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoic acid

Systemtic Name: 2-(6-methyl-2-methylsulfanyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoic acid Openeye Name: 2-(6-methyl-2-methylsulfanyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid CAS Name: 2-[6-methyl-2-(methylthio)-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl]acetic acid IUPAC Name: 2-(6-methyl-2-methylsulfanyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetic acid Traditional Name: 2-[4-keto-6-methyl-2-(methylthio)-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]acetic acid Formula: C16H14N2O3S2 MolecularWeight: 346.42396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(N(C2=O)CC(=O)O)SC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(S1)N=C(N(C2=O)CC(=O)O)SC)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O3S2/c1-9-12(10-6-4-3-5-7-10)13-14(23-9)17-16(22-2)18(15(13)21)8-11(19)20/h3-7H,8H2,1-2H3,(H,19,20)