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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

InChI

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