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

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-2-(4-chloranylphenoxy)ethanamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thienyl]-2-(4-chlorophenoxy)acetamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thiophenyl]-2-(4-chlorophenoxy)acetamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-2-(4-chlorophenoxy)acetamide Traditional Name: 2-(4-chlorophenoxy)-N-(3-cyano-4-methyl-5-piperonyl-2-thienyl)acetamide Formula: C22H17ClN2O4S MolecularWeight: 440.89938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)COC2=CC=C(C=C2)Cl)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)COC2=CC=C(C=C2)Cl)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H17ClN2O4S/c1-13-17(10-24)22(25-21(26)11-27-16-5-3-15(23)4-6-16)30-20(13)9-14-2-7-18-19(8-14)29-12-28-18/h2-8H,9,11-12H2,1H3,(H,25,26)