[(5R)-1-ethyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(3-methylsulfanylpropyl)azanium

Systemtic Name: [(5R)-1-ethyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(3-methylsulfanylpropyl)azanium Openeye Name: [(5R)-1-ethyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(3-methylsulfanylpropyl)ammonium CAS Name: [(5R)-1-ethyl-3-[oxo(thiomorpholin-4-yl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-[3-(methylthio)propyl]ammonium IUPAC Name: [(5R)-1-ethyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(3-methylsulfanylpropyl)azanium Traditional Name: [(5R)-1-ethyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-[3-(methylthio)propyl]ammonium Formula: C18H31N4OS2+ MolecularWeight: 383.59494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)[NH2+]CCCSC)C(=N1)C(=O)N3CCSCC3

Isomeric SMILES

CCN1C2=C(C[C@@H](CC2)[NH2+]CCCSC)C(=N1)C(=O)N3CCSCC3

InChI

InChI=1S/C18H30N4OS2/c1-3-22-16-6-5-14(19-7-4-10-24-2)13-15(16)17(20-22)18(23)21-8-11-25-12-9-21/h14,19H,3-13H2,1-2H3/p+1/t14-/m1/s1