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

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-2,6-bis(fluoranyl)benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thienyl]-2,6-difluoro-benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thiophenyl]-2,6-difluorobenzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-2,6-difluorobenzamide Traditional Name: N-(3-cyano-4-methyl-5-piperonyl-2-thienyl)-2,6-difluoro-benzamide Formula: C21H14F2N2O3S MolecularWeight: 412.409266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC=C2F)F)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=C(C=CC=C2F)F)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H14F2N2O3S/c1-11-13(9-24)21(25-20(26)19-14(22)3-2-4-15(19)23)29-18(11)8-12-5-6-16-17(7-12)28-10-27-16/h2-7H,8,10H2,1H3,(H,25,26)