N-[(3-bromophenyl)methyl]-1-(6H-thieno[2,3-b]pyrrol-5-ylcarbonyl)piperidine-4-carboxamide

Systemtic Name: N-[(3-bromophenyl)methyl]-1-(6H-thieno[2,3-b]pyrrol-5-ylcarbonyl)piperidine-4-carboxamide Openeye Name: N-[(3-bromophenyl)methyl]-1-(6H-thieno[2,3-b]pyrrole-5-carbonyl)piperidine-4-carboxamide CAS Name: N-[(3-bromophenyl)methyl]-1-[oxo(6H-thieno[2,3-b]pyrrol-5-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[(3-bromophenyl)methyl]-1-(6H-thieno[2,3-b]pyrrole-5-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-bromobenzyl)-1-(6H-thieno[2,3-b]pyrrole-5-carbonyl)isonipecotamide Formula: C20H20BrN3O2S MolecularWeight: 446.3607

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC(=CC=C2)Br)C(=O)C3=CC4=C(N3)SC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC(=CC=C2)Br)C(=O)C3=CC4=C(N3)SC=C4

InChI

InChI=1S/C20H20BrN3O2S/c21-16-3-1-2-13(10-16)12-22-18(25)14-4-7-24(8-5-14)20(26)17-11-15-6-9-27-19(15)23-17/h1-3,6,9-11,14,23H,4-5,7-8,12H2,(H,22,25)