(3S)-N-(benzimidazol-1-yl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(benzimidazol-1-yl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(benzimidazol-1-yl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-(1-benzimidazolyl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(benzimidazol-1-yl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(benzimidazol-1-yl)-1-(2-thienylsulfonyl)nipecotamide Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NN3C=NC4=CC=CC=C43

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NN3C=NC4=CC=CC=C43

InChI

InChI=1S/C17H18N4O3S2/c22-17(19-21-12-18-14-6-1-2-7-15(14)21)13-5-3-9-20(11-13)26(23,24)16-8-4-10-25-16/h1-2,4,6-8,10,12-13H,3,5,9,11H2,(H,19,22)/t13-/m0/s1