(3S)-N-[2-(1H-indol-3-yl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-(1H-indol-3-yl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[2-(1H-indol-3-yl)ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[2-(1H-indol-3-yl)ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-(1H-indol-3-yl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[2-(1H-indol-3-yl)ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C20H23N3O3S2 MolecularWeight: 417.54492

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C20H23N3O3S2/c24-20(21-10-9-15-13-22-18-7-2-1-6-17(15)18)16-5-3-11-23(14-16)28(25,26)19-8-4-12-27-19/h1-2,4,6-8,12-13,16,22H,3,5,9-11,14H2,(H,21,24)/t16-/m0/s1