[(5R)-1-ethyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(2-thiophen-2-ylethyl)azanium

Systemtic Name: [(5R)-1-ethyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(2-thiophen-2-ylethyl)azanium Openeye Name: [(5R)-1-ethyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-[2-(2-thienyl)ethyl]ammonium CAS Name: [(5R)-1-ethyl-3-[oxo(thiomorpholin-4-yl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-(2-thiophen-2-ylethyl)ammonium IUPAC Name: [(5R)-1-ethyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(2-thiophen-2-ylethyl)azanium Traditional Name: [(5R)-1-ethyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-[2-(2-thienyl)ethyl]ammonium Formula: C20H29N4OS2+ MolecularWeight: 405.60046

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)[NH2+]CCC3=CC=CS3)C(=N1)C(=O)N4CCSCC4

Isomeric SMILES

CCN1C2=C(C[C@@H](CC2)[NH2+]CCC3=CC=CS3)C(=N1)C(=O)N4CCSCC4

InChI

InChI=1S/C20H28N4OS2/c1-2-24-18-6-5-15(21-8-7-16-4-3-11-27-16)14-17(18)19(22-24)20(25)23-9-12-26-13-10-23/h3-4,11,15,21H,2,5-10,12-14H2,1H3/p+1/t15-/m1/s1