7-bromanyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 7-bromanyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1-benzofuran-2-carboxamide Openeye Name: 7-bromo-N-[1-(p-tolylsulfonyl)-4-piperidyl]benzofuran-2-carboxamide CAS Name: 7-bromo-N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-2-benzofurancarboxamide IUPAC Name: 7-bromo-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1-benzofuran-2-carboxamide Traditional Name: 7-bromo-N-(1-tosyl-4-piperidyl)coumarilamide Formula: C21H21BrN2O4S MolecularWeight: 477.37144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=C(O3)C(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=C(O3)C(=CC=C4)Br

InChI

InChI=1S/C21H21BrN2O4S/c1-14-5-7-17(8-6-14)29(26,27)24-11-9-16(10-12-24)23-21(25)19-13-15-3-2-4-18(22)20(15)28-19/h2-8,13,16H,9-12H2,1H3,(H,23,25)