N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-1,1-dioxo-thiolane-3-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-1,1-dioxo-3-thiolanecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-1,1-dioxothiolane-3-carboxamide Traditional Name: 1,1-diketo-N-[2-(piperonylcarbamoyl)phenyl]thiolane-3-carboxamide Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1C(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CS(=O)(=O)CC1C(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N2O6S/c23-19(14-7-8-29(25,26)11-14)22-16-4-2-1-3-15(16)20(24)21-10-13-5-6-17-18(9-13)28-12-27-17/h1-6,9,14H,7-8,10-12H2,(H,21,24)(H,22,23)