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

Systemtic Name: [(5R)-1-ethyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(thiophen-2-ylmethyl)azanium Openeye Name: [(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(2-thienylmethyl)ammonium CAS Name: [(5R)-1-ethyl-3-[oxo(1-piperidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: [(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(thiophen-2-ylmethyl)azanium Traditional Name: [(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(2-thenyl)ammonium Formula: C20H29N4OS+ MolecularWeight: 373.53546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)[NH2+]CC3=CC=CS3)C(=N1)C(=O)N4CCCCC4

Isomeric SMILES

CCN1C2=C(C[C@@H](CC2)[NH2+]CC3=CC=CS3)C(=N1)C(=O)N4CCCCC4

InChI

InChI=1S/C20H28N4OS/c1-2-24-18-9-8-15(21-14-16-7-6-12-26-16)13-17(18)19(22-24)20(25)23-10-4-3-5-11-23/h6-7,12,15,21H,2-5,8-11,13-14H2,1H3/p+1/t15-/m1/s1