N-[(3-bromophenyl)methyl]-N-cyclopropyl-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[(3-bromophenyl)methyl]-N-cyclopropyl-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[(3-bromophenyl)methyl]-N-cyclopropyl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[(3-bromophenyl)methyl]-N-cyclopropyl-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[(3-bromophenyl)methyl]-N-cyclopropyl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-(3-bromobenzyl)-N-cyclopropyl-1-(2-thenoyl)nipecotamide Formula: C21H23BrN2O2S MolecularWeight: 447.38852

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)N(CC3=CC(=CC=C3)Br)C4CC4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)N(CC3=CC(=CC=C3)Br)C4CC4

InChI

InChI=1S/C21H23BrN2O2S/c22-17-6-1-4-15(12-17)13-24(18-8-9-18)20(25)16-5-2-10-23(14-16)21(26)19-7-3-11-27-19/h1,3-4,6-7,11-12,16,18H,2,5,8-10,13-14H2