2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide Formula: C16H28N5O2S+ MolecularWeight: 354.49082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NCC2(CCCCC2)[NH+]3CCOCC3

Isomeric SMILES

CN1C=NN=C1SCC(=O)NCC2(CCCCC2)[NH+]3CCOCC3

InChI

InChI=1S/C16H27N5O2S/c1-20-13-18-19-15(20)24-11-14(22)17-12-16(5-3-2-4-6-16)21-7-9-23-10-8-21/h13H,2-12H2,1H3,(H,17,22)/p+1