(3S)-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[2-(isopropylamino)-2-oxo-ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[2-(isopropylamino)-2-keto-ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C15H23N3O4S2 MolecularWeight: 373.49082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)NC(=O)CNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C15H23N3O4S2/c1-11(2)17-13(19)9-16-15(20)12-5-3-7-18(10-12)24(21,22)14-6-4-8-23-14/h4,6,8,11-12H,3,5,7,9-10H2,1-2H3,(H,16,20)(H,17,19)/t12-/m0/s1