N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(2-oxothiazolidin-3-yl)propanoylamino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[1-oxo-3-(2-oxo-3-thiazolidinyl)propyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(2-oxo-1,3-thiazolidin-3-yl)propanoylamino]benzamide Traditional Name: 2-[3-(2-ketothiazolidin-3-yl)propanoylamino]-N-piperonyl-benzamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=O)N1CCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CSC(=O)N1CCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O5S/c25-19(7-8-24-9-10-30-21(24)27)23-16-4-2-1-3-15(16)20(26)22-12-14-5-6-17-18(11-14)29-13-28-17/h1-6,11H,7-10,12-13H2,(H,22,26)(H,23,25)