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

Systemtic Name: 2-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate Openeye Name: 2-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[5-(4-bromophenyl)-4-thieno[2,3-d]pyrimidinyl]thio]acetate IUPAC Name: 2-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]thio]acetate Formula: C14H8BrN2O2S2- MolecularWeight: 380.25952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC3=C2C(=NC=N3)SCC(=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C2=CSC3=C2C(=NC=N3)SCC(=O)[O-])Br

InChI

InChI=1S/C14H9BrN2O2S2/c15-9-3-1-8(2-4-9)10-5-20-13-12(10)14(17-7-16-13)21-6-11(18)19/h1-5,7H,6H2,(H,18,19)/p-1