(3S)-N-[(1S)-1-phenylbutyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(1S)-1-phenylbutyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[(1S)-1-phenylbutyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[(1S)-1-phenylbutyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(1S)-1-phenylbutyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[(1S)-1-phenylbutyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H26N2O3S2/c1-2-8-18(16-9-4-3-5-10-16)21-20(23)17-11-6-13-22(15-17)27(24,25)19-12-7-14-26-19/h3-5,7,9-10,12,14,17-18H,2,6,8,11,13,15H2,1H3,(H,21,23)/t17-,18-/m0/s1