2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethyl benzoate

Systemtic Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethyl benzoate Openeye Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethyl benzoate CAS Name: benzoic acid 2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]ethyl ester IUPAC Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethyl benzoate Traditional Name: benzoic acid 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]ethyl ester Formula: C17H16N2O2S2 MolecularWeight: 344.45114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O2S2/c1-11-12(2)23-16-14(11)15(18-10-19-16)22-9-8-21-17(20)13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3