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

Systemtic Name: (phenylmethyl) 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanoate Openeye Name: benzyl 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanoate CAS Name: 2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanoate Traditional Name: 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]butyric acid benzyl ester Formula: C19H20N2O2S2 MolecularWeight: 372.5043

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC1=CC=CC=C1)SC2=NC=NC3=C2C(=C(S3)C)C

Isomeric SMILES

CCC(C(=O)OCC1=CC=CC=C1)SC2=NC=NC3=C2C(=C(S3)C)C

InChI

InChI=1S/C19H20N2O2S2/c1-4-15(19(22)23-10-14-8-6-5-7-9-14)25-18-16-12(2)13(3)24-17(16)20-11-21-18/h5-9,11,15H,4,10H2,1-3H3