N-[(1-phenylpyrrolidin-3-yl)methyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[(1-phenylpyrrolidin-3-yl)methyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[(1-phenylpyrrolidin-3-yl)methyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[(1-phenyl-3-pyrrolidinyl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[(1-phenylpyrrolidin-3-yl)methyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[(1-phenylpyrrolidin-3-yl)methyl]-1-(2-thenoyl)nipecotamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NCC3CCN(C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NCC3CCN(C3)C4=CC=CC=C4

InChI

InChI=1S/C22H27N3O2S/c26-21(18-6-4-11-25(16-18)22(27)20-9-5-13-28-20)23-14-17-10-12-24(15-17)19-7-2-1-3-8-19/h1-3,5,7-9,13,17-18H,4,6,10-12,14-16H2,(H,23,26)