2-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate

Systemtic Name: 2-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate Openeye Name: 2-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(2-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]acetate IUPAC Name: 2-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)thio]acetate Formula: C15H11N2O2S2- MolecularWeight: 315.39004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=N1)SCC(=O)[O-]

Isomeric SMILES

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=N1)SCC(=O)[O-]

InChI

InChI=1S/C15H12N2O2S2/c1-9-16-14-13(15(17-9)21-8-12(18)19)11(7-20-14)10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,18,19)/p-1