2-[4-oxidanylidene-3-(phenylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[4-oxidanylidene-3-(phenylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoic acid Openeye Name: 2-(3-benzyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanylacetic acid CAS Name: 2-[[4-oxo-3-(phenylmethyl)-2-thieno[3,2-d]pyrimidinyl]thio]acetic acid IUPAC Name: 2-(3-benzyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanylacetic acid Traditional Name: 2-[(3-benzyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]acetic acid Formula: C15H12N2O3S2 MolecularWeight: 332.39738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)O

InChI

InChI=1S/C15H12N2O3S2/c18-12(19)9-22-15-16-11-6-7-21-13(11)14(20)17(15)8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,18,19)