N-[2-(tert-butylcarbamoyl)phenyl]-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide

Systemtic Name: N-[2-(tert-butylcarbamoyl)phenyl]-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide Openeye Name: N-[2-(tert-butylcarbamoyl)phenyl]-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide CAS Name: N-[2-[(tert-butylamino)-oxomethyl]phenyl]-1-[(2,4-dichlorophenyl)methylsulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(tert-butylcarbamoyl)phenyl]-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide Traditional Name: N-[2-(tert-butylcarbamoyl)phenyl]-1-(2,4-dichlorobenzyl)sulfonyl-nipecotamide Formula: C24H29Cl2N3O4S MolecularWeight: 526.47576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C24H29Cl2N3O4S/c1-24(2,3)28-23(31)19-8-4-5-9-21(19)27-22(30)16-7-6-12-29(14-16)34(32,33)15-17-10-11-18(25)13-20(17)26/h4-5,8-11,13,16H,6-7,12,14-15H2,1-3H3,(H,27,30)(H,28,31)