N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-5-oxidanylidene-N-(phenylmethyl)thiolane-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-5-oxidanylidene-N-(phenylmethyl)thiolane-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-N-benzyl-5-oxo-tetrahydrothiophene-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-5-oxo-N-(phenylmethyl)-3-thiolanecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-N-benzyl-5-oxothiolane-3-carboxamide Traditional Name: N-benzyl-5-keto-N-[2-keto-2-(piperonylamino)ethyl]tetrahydrothiophene-3-carboxamide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CSC1=O)C(=O)N(CC2=CC=CC=C2)CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C(CSC1=O)C(=O)N(CC2=CC=CC=C2)CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N2O5S/c25-20(23-10-16-6-7-18-19(8-16)29-14-28-18)12-24(11-15-4-2-1-3-5-15)22(27)17-9-21(26)30-13-17/h1-8,17H,9-14H2,(H,23,25)