1-[(4-bromophenyl)methylsulfonyl]-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methylsulfonyl]-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]piperidine-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methylsulfonyl]-N-[3-(3,5-dimethyl-1-piperidyl)propyl]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)methylsulfonyl]-N-[3-(3,5-dimethyl-1-piperidinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methylsulfonyl]-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzyl)sulfonyl-N-[3-(3,5-dimethylpiperidino)propyl]isonipecotamide Formula: C23H36BrN3O3S MolecularWeight: 514.51924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1CC(CN(C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C23H36BrN3O3S/c1-18-14-19(2)16-26(15-18)11-3-10-25-23(28)21-8-12-27(13-9-21)31(29,30)17-20-4-6-22(24)7-5-20/h4-7,18-19,21H,3,8-17H2,1-2H3,(H,25,28)