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

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-3,4-dimethyl-benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thienyl]-3,4-dimethyl-benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thiophenyl]-3,4-dimethylbenzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-3,4-dimethylbenzamide Traditional Name: N-(3-cyano-4-methyl-5-piperonyl-2-thienyl)-3,4-dimethyl-benzamide Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)CC3=CC4=C(C=C3)OCO4)C)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)CC3=CC4=C(C=C3)OCO4)C)C#N)C

InChI

InChI=1S/C23H20N2O3S/c1-13-4-6-17(8-14(13)2)22(26)25-23-18(11-24)15(3)21(29-23)10-16-5-7-19-20(9-16)28-12-27-19/h4-9H,10,12H2,1-3H3,(H,25,26)