N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methylsulfanylethanoylamino)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methylsulfanylethanoylamino)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-methylsulfanylacetyl)amino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(methylthio)-1-oxoethyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-methylsulfanylacetyl)amino]benzamide Traditional Name: 2-[[2-(methylthio)acetyl]amino]-N-piperonyl-benzamide Formula: C18H18N2O4S MolecularWeight: 358.41152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)NC1=CC=CC=C1C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CSCC(=O)NC1=CC=CC=C1C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18N2O4S/c1-25-10-17(21)20-14-5-3-2-4-13(14)18(22)19-9-12-6-7-15-16(8-12)24-11-23-15/h2-8H,9-11H2,1H3,(H,19,22)(H,20,21)