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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-ethyl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: 2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)thio]-N-piperonyl-acetamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN=C2SCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC2=C(S1)N=CN=C2SCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17N3O3S2/c1-2-12-6-13-17(20-9-21-18(13)26-12)25-8-16(22)19-7-11-3-4-14-15(5-11)24-10-23-14/h3-6,9H,2,7-8,10H2,1H3,(H,19,22)