(5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-thiomorpholin-4-ium-4-ylpiperidin-1-yl)carbonyl-piperidin-2-one

Systemtic Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-thiomorpholin-4-ium-4-ylpiperidin-1-yl)carbonyl-piperidin-2-one Openeye Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-thiomorpholin-4-ium-4-ylpiperidine-1-carbonyl)piperidin-2-one CAS Name: (5S)-1-[3-(4-morpholin-4-iumyl)propyl]-5-[oxo-[4-(4-thiomorpholin-4-iumyl)-1-piperidinyl]methyl]-2-piperidinone IUPAC Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-thiomorpholin-4-ium-4-ylpiperidine-1-carbonyl)piperidin-2-one Traditional Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-thiomorpholin-4-ium-4-ylpiperidine-1-carbonyl)-2-piperidone Formula: C22H40N4O3S+2 MolecularWeight: 440.643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)N2CCC(CC2)[NH+]3CCSCC3)CCC[NH+]4CCOCC4

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)N2CCC(CC2)[NH+]3CCSCC3)CCC[NH+]4CCOCC4

InChI

InChI=1S/C22H38N4O3S/c27-21-3-2-19(18-26(21)7-1-6-23-10-14-29-15-11-23)22(28)25-8-4-20(5-9-25)24-12-16-30-17-13-24/h19-20H,1-18H2/p+2/t19-/m0/s1