N-(3,3-dimethyl-1-phenyl-butyl)-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3,3-dimethyl-1-phenyl-butyl)-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-(3,3-dimethyl-1-phenyl-butyl)piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-(3,3-dimethyl-1-phenylbutyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-(3,3-dimethyl-1-phenylbutyl)piperidine-4-carboxamide Traditional Name: 1-(4-acetylphenyl)sulfonyl-N-(3,3-dimethyl-1-phenyl-butyl)isonipecotamide Formula: C26H34N2O4S MolecularWeight: 470.62416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N2O4S/c1-19(29)20-10-12-23(13-11-20)33(31,32)28-16-14-22(15-17-28)25(30)27-24(18-26(2,3)4)21-8-6-5-7-9-21/h5-13,22,24H,14-18H2,1-4H3,(H,27,30)