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

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-4-ethoxy-benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thienyl]-4-ethoxy-benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thiophenyl]-4-ethoxybenzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-4-ethoxybenzamide Traditional Name: N-(3-cyano-4-methyl-5-piperonyl-2-thienyl)-4-ethoxy-benzamide Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)CC3=CC4=C(C=C3)OCO4)C)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)CC3=CC4=C(C=C3)OCO4)C)C#N

InChI

InChI=1S/C23H20N2O4S/c1-3-27-17-7-5-16(6-8-17)22(26)25-23-18(12-24)14(2)21(30-23)11-15-4-9-19-20(10-15)29-13-28-19/h4-10H,3,11,13H2,1-2H3,(H,25,26)