N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-3-methyl-benzofuran-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-(3,5-dimethylpiperidino)sulfonyl-N-homoveratryl-3-methyl-coumarilamide Formula: C27H34N2O6S MolecularWeight: 514.63366

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)NCCC4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)NCCC4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C27H34N2O6S/c1-17-12-18(2)16-29(15-17)36(31,32)21-7-9-23-22(14-21)19(3)26(35-23)27(30)28-11-10-20-6-8-24(33-4)25(13-20)34-5/h6-9,13-14,17-18H,10-12,15-16H2,1-5H3,(H,28,30)