N-[1-(4-tert-butylphenyl)ethyl]-1-[(2-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-1-[(2-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-[1-(4-tert-butylphenyl)ethyl]-1-[(2-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-[1-(4-tert-butylphenyl)ethyl]-1-[(2-chlorophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[1-(4-tert-butylphenyl)ethyl]-1-[(2-chlorophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-[1-(4-tert-butylphenyl)ethyl]-1-(2-chlorobenzyl)sulfonyl-isonipecotamide Formula: C25H33ClN2O3S MolecularWeight: 477.05912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3Cl

InChI

InChI=1S/C25H33ClN2O3S/c1-18(19-9-11-22(12-10-19)25(2,3)4)27-24(29)20-13-15-28(16-14-20)32(30,31)17-21-7-5-6-8-23(21)26/h5-12,18,20H,13-17H2,1-4H3,(H,27,29)