1-(4-bromophenyl)sulfonyl-N-[1-(ethylamino)-1-oxidanylidene-propan-2-yl]piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[1-(ethylamino)-1-oxidanylidene-propan-2-yl]piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[2-(ethylamino)-1-methyl-2-oxo-ethyl]piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[1-(ethylamino)-1-oxopropan-2-yl]-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[1-(ethylamino)-1-oxopropan-2-yl]piperidine-3-carboxamide Traditional Name: 1-brosyl-N-[2-(ethylamino)-2-keto-1-methyl-ethyl]nipecotamide Formula: C17H24BrN3O4S MolecularWeight: 446.35916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24BrN3O4S/c1-3-19-16(22)12(2)20-17(23)13-5-4-10-21(11-13)26(24,25)15-8-6-14(18)7-9-15/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,19,22)(H,20,23)