N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide CAS Name: N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-(benzylthio)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide Formula: C20H31N2O2S+ MolecularWeight: 363.53734

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CSCC2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CSCC2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C20H30N2O2S/c23-19(16-25-15-18-7-3-1-4-8-18)21-17-20(9-5-2-6-10-20)22-11-13-24-14-12-22/h1,3-4,7-8H,2,5-6,9-17H2,(H,21,23)/p+1