N-[3,4-bis(fluoranyl)phenyl]-3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-carboxamide Openeye Name: N-(3,4-difluorophenyl)-3-methyl-5-(1-piperidylsulfonyl)benzofuran-2-carboxamide CAS Name: N-(3,4-difluorophenyl)-3-methyl-5-(1-piperidinylsulfonyl)-2-benzofurancarboxamide IUPAC Name: N-(3,4-difluorophenyl)-3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-carboxamide Traditional Name: N-(3,4-difluorophenyl)-3-methyl-5-piperidinosulfonyl-coumarilamide Formula: C21H20F2N2O4S MolecularWeight: 434.456306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)NC4=CC(=C(C=C4)F)F

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)NC4=CC(=C(C=C4)F)F

InChI

InChI=1S/C21H20F2N2O4S/c1-13-16-12-15(30(27,28)25-9-3-2-4-10-25)6-8-19(16)29-20(13)21(26)24-14-5-7-17(22)18(23)11-14/h5-8,11-12H,2-4,9-10H2,1H3,(H,24,26)