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

Systemtic Name: (3S)-N-[(1R)-1-phenylethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[(1R)-1-phenylethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[(1R)-1-phenylethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(1R)-1-phenylethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[(1R)-1-phenylethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3S2/c1-14(15-7-3-2-4-8-15)19-18(21)16-9-5-11-20(13-16)25(22,23)17-10-6-12-24-17/h2-4,6-8,10,12,14,16H,5,9,11,13H2,1H3,(H,19,21)/t14-,16+/m1/s1