3-methyl-N-(3-methylbutyl)-5-(4-methylpiperidin-1-yl)sulfonyl-1-benzofuran-2-carboxamide

Systemtic Name: 3-methyl-N-(3-methylbutyl)-5-(4-methylpiperidin-1-yl)sulfonyl-1-benzofuran-2-carboxamide Openeye Name: N-isopentyl-3-methyl-5-[(4-methyl-1-piperidyl)sulfonyl]benzofuran-2-carboxamide CAS Name: 3-methyl-N-(3-methylbutyl)-5-[(4-methyl-1-piperidinyl)sulfonyl]-2-benzofurancarboxamide IUPAC Name: 3-methyl-N-(3-methylbutyl)-5-(4-methylpiperidin-1-yl)sulfonyl-1-benzofuran-2-carboxamide Traditional Name: N-isoamyl-3-methyl-5-(4-methylpiperidino)sulfonyl-coumarilamide Formula: C21H30N2O4S MolecularWeight: 406.5389

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)NCCC(C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)NCCC(C)C

InChI

InChI=1S/C21H30N2O4S/c1-14(2)7-10-22-21(24)20-16(4)18-13-17(5-6-19(18)27-20)28(25,26)23-11-8-15(3)9-12-23/h5-6,13-15H,7-12H2,1-4H3,(H,22,24)