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

Systemtic Name: (3S)-N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[2-(dimethylamino)-2-oxo-ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[2-(dimethylamino)-2-oxoethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-(dimethylamino)-2-oxoethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[2-(dimethylamino)-2-keto-ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C14H21N3O4S2 MolecularWeight: 359.46424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O4S2/c1-16(2)12(18)9-15-14(19)11-5-3-7-17(10-11)23(20,21)13-6-4-8-22-13/h4,6,8,11H,3,5,7,9-10H2,1-2H3,(H,15,19)/t11-/m0/s1