N-[1-(1-benzofuran-2-yl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(1-benzofuran-2-yl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(benzofuran-2-yl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(2-benzofuranyl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(1-benzofuran-2-yl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(benzofuran-2-yl)ethyl]-1-mesitylsulfonyl-isonipecotamide Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC4=CC=CC=C4O3)C

InChI

InChI=1S/C25H30N2O4S/c1-16-13-17(2)24(18(3)14-16)32(29,30)27-11-9-20(10-12-27)25(28)26-19(4)23-15-21-7-5-6-8-22(21)31-23/h5-8,13-15,19-20H,9-12H2,1-4H3,(H,26,28)