2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoic acid

Systemtic Name: 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoic acid Openeye Name: 2-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoic acid CAS Name: 2-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]propanoic acid IUPAC Name: 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoic acid Traditional Name: 2-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]propionic acid Formula: C16H14N2O2S2 MolecularWeight: 330.42456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SC(C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SC(C)C(=O)O

InChI

InChI=1S/C16H14N2O2S2/c1-9-3-5-11(6-4-9)12-7-21-14-13(12)15(18-8-17-14)22-10(2)16(19)20/h3-8,10H,1-2H3,(H,19,20)