N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-2,6-dimethoxy-benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thienyl]-2,6-dimethoxy-benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thiophenyl]-2,6-dimethoxybenzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-2,6-dimethoxybenzamide Traditional Name: N-(3-cyano-4-methyl-5-piperonyl-2-thienyl)-2,6-dimethoxy-benzamide Formula: C23H20N2O5S MolecularWeight: 436.4803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC=C2OC)OC)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC=C2OC)OC)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H20N2O5S/c1-13-15(11-24)23(25-22(26)21-17(27-2)5-4-6-18(21)28-3)31-20(13)10-14-7-8-16-19(9-14)30-12-29-16/h4-9H,10,12H2,1-3H3,(H,25,26)