(2S)-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: (2S)-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: (2S)-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: (2S)-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: (2S)-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: (2S)-N-(4,5,6,7-tetrahydroanthranil-3-yl)-1-(2-thienylsulfonyl)pipecolinamide Formula: C17H21N3O4S2 MolecularWeight: 395.49634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=C3CCCCC3=NO2)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)NC2=C3CCCCC3=NO2)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C17H21N3O4S2/c21-16(18-17-12-6-1-2-7-13(12)19-24-17)14-8-3-4-10-20(14)26(22,23)15-9-5-11-25-15/h5,9,11,14H,1-4,6-8,10H2,(H,18,21)/t14-/m0/s1