(phenylmethyl) 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate

Systemtic Name: (phenylmethyl) 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate Openeye Name: benzyl 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate CAS Name: 2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate Traditional Name: 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]propionic acid benzyl ester Formula: C18H18N2O2S2 MolecularWeight: 358.47772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SC(C)C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SC(C)C(=O)OCC3=CC=CC=C3)C

InChI

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