1-(4-bromophenyl)sulfonyl-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-methyl-piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-methyl-piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[2-(tert-butylamino)-2-oxo-ethyl]-N-methyl-piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[2-(tert-butylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide Traditional Name: 1-brosyl-N-[2-(tert-butylamino)-2-keto-ethyl]-N-methyl-nipecotamide Formula: C19H28BrN3O4S MolecularWeight: 474.41232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H28BrN3O4S/c1-19(2,3)21-17(24)13-22(4)18(25)14-6-5-11-23(12-14)28(26,27)16-9-7-15(20)8-10-16/h7-10,14H,5-6,11-13H2,1-4H3,(H,21,24)