N-[(2S)-1-[(2-methoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(2S)-1-[(2-methoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(1S)-1-[(2-methoxyphenyl)methylcarbamoyl]-2-methyl-propyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(2S)-1-[(2-methoxyphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(2S)-1-[(2-methoxyphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(1S)-2-methyl-1-(o-anisylcarbamoyl)propyl]isonipecotamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=CC=C1OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=CC=C1OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O5S/c1-18(2)23(25(30)26-17-20-9-7-8-12-22(20)33-3)27-24(29)19-13-15-28(16-14-19)34(31,32)21-10-5-4-6-11-21/h4-12,18-19,23H,13-17H2,1-3H3,(H,26,30)(H,27,29)/t23-/m0/s1