(5S)-1-(cyclohexylmethyl)-N-methyl-5-thiomorpholin-4-ium-4-yl-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: (5S)-1-(cyclohexylmethyl)-N-methyl-5-thiomorpholin-4-ium-4-yl-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: (5S)-1-(cyclohexylmethyl)-N-methyl-5-thiomorpholin-4-ium-4-yl-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: (5S)-1-(cyclohexylmethyl)-N-methyl-5-(4-thiomorpholin-4-iumyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: (5S)-1-(cyclohexylmethyl)-N-methyl-5-thiomorpholin-4-ium-4-yl-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: (5S)-1-(cyclohexylmethyl)-N-methyl-5-thiomorpholin-4-ium-4-yl-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C20H33N4OS+ MolecularWeight: 377.56722

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C2=C1CC(CC2)[NH+]3CCSCC3)CC4CCCCC4

Isomeric SMILES

CNC(=O)C1=NN(C2=C1C[C@H](CC2)[NH+]3CCSCC3)CC4CCCCC4

InChI

InChI=1S/C20H32N4OS/c1-21-20(25)19-17-13-16(23-9-11-26-12-10-23)7-8-18(17)24(22-19)14-15-5-3-2-4-6-15/h15-16H,2-14H2,1H3,(H,21,25)/p+1/t16-/m0/s1