N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: N-cyclopentyl-2-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-piperonyl-acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)CN4C=NC5=C(C4=O)C=CS5

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)CN4C=NC5=C(C4=O)C=CS5

InChI

InChI=1S/C21H21N3O4S/c25-19(11-23-12-22-20-16(21(23)26)7-8-29-20)24(15-3-1-2-4-15)10-14-5-6-17-18(9-14)28-13-27-17/h5-9,12,15H,1-4,10-11,13H2