methyl 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylbutanoate

Systemtic Name: methyl 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylbutanoate Openeye Name: methyl 2-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylbutanoate CAS Name: 2-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]butanoic acid methyl ester IUPAC Name: methyl 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylbutanoate Traditional Name: 2-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]butyric acid methyl ester Formula: C18H18N2O2S2 MolecularWeight: 358.47772

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC)SC1=NC=NC2=C1C(=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)OC)SC1=NC=NC2=C1C(=CS2)C3=CC=C(C=C3)C

InChI

InChI=1S/C18H18N2O2S2/c1-4-14(18(21)22-3)24-17-15-13(9-23-16(15)19-10-20-17)12-7-5-11(2)6-8-12/h5-10,14H,4H2,1-3H3