N-(1,3-benzodioxol-5-ylmethyl)-2-(2-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-ethyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-ethyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: 2-[(2-ethyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)thio]-N-piperonyl-acetamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=C(S2)C)C)C(=N1)SCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=NC2=C(C(=C(S2)C)C)C(=N1)SCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O3S2/c1-4-16-22-19(18-11(2)12(3)28-20(18)23-16)27-9-17(24)21-8-13-5-6-14-15(7-13)26-10-25-14/h5-7H,4,8-10H2,1-3H3,(H,21,24)