2-(3,5-dimethylphenoxy)ethyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate CAS Name: 2-(4-thieno[2,3-d]pyrimidinylthio)acetic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate Traditional Name: 2-(thieno[2,3-d]pyrimidin-4-ylthio)acetic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC(=O)CSC2=NC=NC3=C2C=CS3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC(=O)CSC2=NC=NC3=C2C=CS3)C

InChI

InChI=1S/C18H18N2O3S2/c1-12-7-13(2)9-14(8-12)22-4-5-23-16(21)10-25-18-15-3-6-24-17(15)19-11-20-18/h3,6-9,11H,4-5,10H2,1-2H3