2-(1,3-benzodioxol-5-yloxy)-N-(5-ethyl-6-methyl-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yloxy)-N-(5-ethyl-6-methyl-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yloxy)-N-(5-ethyl-6-methyl-4-oxo-2-thioxo-1H-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: 2-(1,3-benzodioxol-5-yloxy)-N-(5-ethyl-6-methyl-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)acetamide IUPAC Name: 2-(1,3-benzodioxol-5-yloxy)-N-(5-ethyl-6-methyl-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: 2-(1,3-benzodioxol-5-yloxy)-N-(5-ethyl-4-keto-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=S)N2)NC(=O)COC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=S)N2)NC(=O)COC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C18H17N3O5S2/c1-3-11-9(2)28-16-15(11)17(23)21(18(27)19-16)20-14(22)7-24-10-4-5-12-13(6-10)26-8-25-12/h4-6H,3,7-8H2,1-2H3,(H,19,27)(H,20,22)