2-[5-[2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylethanoyl]thiophen-2-yl]ethanoic acid

Systemtic Name: 2-[5-[2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylethanoyl]thiophen-2-yl]ethanoic acid Openeye Name: 2-[5-[2-[4-(2-thienyl)pyrimidin-2-yl]sulfanylacetyl]-2-thienyl]acetic acid CAS Name: 2-[5-[1-oxo-2-[(4-thiophen-2-yl-2-pyrimidinyl)thio]ethyl]-2-thiophenyl]acetic acid IUPAC Name: 2-[5-[2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylacetyl]thiophen-2-yl]acetic acid Traditional Name: 2-[5-[2-[[4-(2-thienyl)pyrimidin-2-yl]thio]acetyl]-2-thienyl]acetic acid Formula: C16H12N2O3S3 MolecularWeight: 376.47308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NC=C2)SCC(=O)C3=CC=C(S3)CC(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NC=C2)SCC(=O)C3=CC=C(S3)CC(=O)O

InChI

InChI=1S/C16H12N2O3S3/c19-12(14-4-3-10(24-14)8-15(20)21)9-23-16-17-6-5-11(18-16)13-2-1-7-22-13/h1-7H,8-9H2,(H,20,21)