1-(4-bromophenyl)carbonyl-N-(2-cyclopentylsulfanylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-(2-cyclopentylsulfanylphenyl)piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-(2-cyclopentylsulfanylphenyl)piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-[2-(cyclopentylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-(2-cyclopentylsulfanylphenyl)piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-[2-(cyclopentylthio)phenyl]isonipecotamide Formula: C24H27BrN2O2S MolecularWeight: 487.45238

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=CC=C2NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCC(C1)SC2=CC=CC=C2NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H27BrN2O2S/c25-19-11-9-18(10-12-19)24(29)27-15-13-17(14-16-27)23(28)26-21-7-3-4-8-22(21)30-20-5-1-2-6-20/h3-4,7-12,17,20H,1-2,5-6,13-16H2,(H,26,28)