2-methylpropyl 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoate

Systemtic Name: 2-methylpropyl 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoate Openeye Name: isobutyl 2-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoate CAS Name: 2-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoate Traditional Name: 2-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]propionic acid isobutyl ester Formula: C20H22N2O2S2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O2S2/c1-12(2)9-24-20(23)14(4)26-19-17-16(10-25-18(17)21-11-22-19)15-7-5-13(3)6-8-15/h5-8,10-12,14H,9H2,1-4H3