N-[2-(4-chlorophenyl)ethyl]-1-(3-pyrrol-1-ylthiophen-2-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-1-(3-pyrrol-1-ylthiophen-2-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-1-(3-pyrrol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-1-[oxo-[3-(1-pyrrolyl)-2-thiophenyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-1-(3-pyrrol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-1-(3-pyrrol-1-ylthiophene-2-carbonyl)isonipecotamide Formula: C23H24ClN3O2S MolecularWeight: 441.97356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=CC=C(C=C2)Cl)C(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=CC=C(C=C2)Cl)C(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C23H24ClN3O2S/c24-19-5-3-17(4-6-19)7-11-25-22(28)18-8-14-27(15-9-18)23(29)21-20(10-16-30-21)26-12-1-2-13-26/h1-6,10,12-13,16,18H,7-9,11,14-15H2,(H,25,28)