N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)propanoylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)propanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-methyl-2-oxo-thiazol-3-yl)propanoylamino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[3-(4-methyl-2-oxo-3-thiazolyl)-1-oxopropyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanoylamino]benzamide Traditional Name: 2-[3-(2-keto-4-methyl-4-thiazolin-3-yl)propanoylamino]-N-piperonyl-benzamide Formula: C22H21N3O5S MolecularWeight: 439.48424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CSC(=O)N1CCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H21N3O5S/c1-14-12-31-22(28)25(14)9-8-20(26)24-17-5-3-2-4-16(17)21(27)23-11-15-6-7-18-19(10-15)30-13-29-18/h2-7,10,12H,8-9,11,13H2,1H3,(H,23,27)(H,24,26)