N-[2-(tert-butylcarbamoyl)-1-benzofuran-3-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(tert-butylcarbamoyl)-1-benzofuran-3-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(tert-butylcarbamoyl)benzofuran-3-yl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[(tert-butylamino)-oxomethyl]-3-benzofuranyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(tert-butylcarbamoyl)-1-benzofuran-3-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(tert-butylcarbamoyl)benzofuran-3-yl]-1-tosyl-isonipecotamide Formula: C26H31N3O5S MolecularWeight: 497.60644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(OC4=CC=CC=C43)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(OC4=CC=CC=C43)C(=O)NC(C)(C)C

InChI

InChI=1S/C26H31N3O5S/c1-17-9-11-19(12-10-17)35(32,33)29-15-13-18(14-16-29)24(30)27-22-20-7-5-6-8-21(20)34-23(22)25(31)28-26(2,3)4/h5-12,18H,13-16H2,1-4H3,(H,27,30)(H,28,31)