methyl 2-[(4-chloranyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[(4-chloranyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethanoate Openeye Name: methyl 2-[(4-chloro-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]acetate CAS Name: 2-[(4-chloro-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[(4-chloro-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(4-chloro-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methylthio]acetic acid methyl ester Formula: C12H13ClN2O2S2 MolecularWeight: 316.82682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)CSCC(=O)OC)Cl)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)CSCC(=O)OC)Cl)C

InChI

InChI=1S/C12H13ClN2O2S2/c1-6-7(2)19-12-10(6)11(13)14-8(15-12)4-18-5-9(16)17-3/h4-5H2,1-3H3