(3-methylphenyl)methyl 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate

Systemtic Name: (3-methylphenyl)methyl 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate Openeye Name: m-tolylmethyl 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]acetic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetic acid (3-methylbenzyl) ester Formula: C18H18N2O2S2 MolecularWeight: 358.47772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)CSC2=NC=NC3=C2C(=C(S3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)CSC2=NC=NC3=C2C(=C(S3)C)C

InChI

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