1-(4-bromophenyl)carbonyl-N-[(4-methylphenyl)-thiophen-2-yl-methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-[(4-methylphenyl)-thiophen-2-yl-methyl]piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-[p-tolyl(2-thienyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-[(4-methylphenyl)-thiophen-2-ylmethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-[(4-methylphenyl)-thiophen-2-ylmethyl]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-[p-tolyl(2-thienyl)methyl]isonipecotamide Formula: C25H25BrN2O2S MolecularWeight: 497.4472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H25BrN2O2S/c1-17-4-6-18(7-5-17)23(22-3-2-16-31-22)27-24(29)19-12-14-28(15-13-19)25(30)20-8-10-21(26)11-9-20/h2-11,16,19,23H,12-15H2,1H3,(H,27,29)