(5S)-1-cyclopropyl-5-(4-thiomorpholin-4-ium-4-ylpiperidin-1-yl)carbonyl-piperidin-2-one

Systemtic Name: (5S)-1-cyclopropyl-5-(4-thiomorpholin-4-ium-4-ylpiperidin-1-yl)carbonyl-piperidin-2-one Openeye Name: (5S)-1-cyclopropyl-5-(4-thiomorpholin-4-ium-4-ylpiperidine-1-carbonyl)piperidin-2-one CAS Name: (5S)-1-cyclopropyl-5-[oxo-[4-(4-thiomorpholin-4-iumyl)-1-piperidinyl]methyl]-2-piperidinone IUPAC Name: (5S)-1-cyclopropyl-5-(4-thiomorpholin-4-ium-4-ylpiperidine-1-carbonyl)piperidin-2-one Traditional Name: (5S)-1-cyclopropyl-5-(4-thiomorpholin-4-ium-4-ylpiperidine-1-carbonyl)-2-piperidone Formula: C18H30N3O2S+ MolecularWeight: 352.5147

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2CC(CCC2=O)C(=O)N3CCC(CC3)[NH+]4CCSCC4

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)N2CCC(CC2)[NH+]3CCSCC3)C4CC4

InChI

InChI=1S/C18H29N3O2S/c22-17-4-1-14(13-21(17)16-2-3-16)18(23)20-7-5-15(6-8-20)19-9-11-24-12-10-19/h14-16H,1-13H2/p+1/t14-/m0/s1