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

Systemtic Name: N-[(1-phenylpyrrolidin-3-yl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[(1-phenylpyrrolidin-3-yl)methyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[(1-phenyl-3-pyrrolidinyl)methyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(1-phenylpyrrolidin-3-yl)methyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[(1-phenylpyrrolidin-3-yl)methyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O3S2/c25-21(22-14-17-10-12-23(15-17)19-7-2-1-3-8-19)18-6-4-11-24(16-18)29(26,27)20-9-5-13-28-20/h1-3,5,7-9,13,17-18H,4,6,10-12,14-16H2,(H,22,25)