N-(1,3-benzodioxol-5-yl)-1-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]isonipecotamide Formula: C20H20N4O4S MolecularWeight: 412.4622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)CC4=NC(=O)C5=C(N4)C=CS5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)CC4=NC(=O)C5=C(N4)C=CS5

InChI

InChI=1S/C20H20N4O4S/c25-19(21-13-1-2-15-16(9-13)28-11-27-15)12-3-6-24(7-4-12)10-17-22-14-5-8-29-18(14)20(26)23-17/h1-2,5,8-9,12H,3-4,6-7,10-11H2,(H,21,25)(H,22,23,26)