N-[1-(4-bromophenyl)propyl]-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(4-bromophenyl)propyl]-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(4-bromophenyl)propyl]-1-(4-cyanophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(4-bromophenyl)propyl]-1-(4-cyanophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(4-bromophenyl)propyl]-1-(4-cyanophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(4-bromophenyl)propyl]-1-(4-cyanophenyl)sulfonyl-isonipecotamide Formula: C22H24BrN3O3S MolecularWeight: 490.41326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCC(C1=CC=C(C=C1)Br)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H24BrN3O3S/c1-2-21(17-5-7-19(23)8-6-17)25-22(27)18-11-13-26(14-12-18)30(28,29)20-9-3-16(15-24)4-10-20/h3-10,18,21H,2,11-14H2,1H3,(H,25,27)