(3S)-N-(4-oxidanylcyclohexyl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(4-oxidanylcyclohexyl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(4-hydroxycyclohexyl)-1-(8-quinolylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-(4-hydroxycyclohexyl)-1-(8-quinolinylsulfonyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(4-hydroxycyclohexyl)-1-quinolin-8-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(4-hydroxycyclohexyl)-1-(8-quinolylsulfonyl)nipecotamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)NC4CCC(CC4)O

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)NC4CCC(CC4)O

InChI

InChI=1S/C21H27N3O4S/c25-18-10-8-17(9-11-18)23-21(26)16-6-3-13-24(14-16)29(27,28)19-7-1-4-15-5-2-12-22-20(15)19/h1-2,4-5,7,12,16-18,25H,3,6,8-11,13-14H2,(H,23,26)/t16-,17?,18?/m0/s1