2-[2-methyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoic acid

Systemtic Name: 2-[2-methyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoic acid Openeye Name: 2-[5-(4-isopropylphenyl)-2-methyl-thieno[2,3-d]pyrimidin-4-yl]sulfanylacetic acid CAS Name: 2-[[2-methyl-5-(4-propan-2-ylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]acetic acid IUPAC Name: 2-[2-methyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetic acid Traditional Name: 2-[(2-methyl-5-p-cumenyl-thieno[2,3-d]pyrimidin-4-yl)thio]acetic acid Formula: C18H18N2O2S2 MolecularWeight: 358.47772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O2S2/c1-10(2)12-4-6-13(7-5-12)14-8-23-17-16(14)18(20-11(3)19-17)24-9-15(21)22/h4-8,10H,9H2,1-3H3,(H,21,22)