1-methyl-N-(2-morpholin-4-ium-4-ylethyl)-5-(2-thiophen-2-ylethanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

Systemtic Name: 1-methyl-N-(2-morpholin-4-ium-4-ylethyl)-5-(2-thiophen-2-ylethanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide Openeye Name: 1-methyl-N-(2-morpholin-4-ium-4-ylethyl)-5-[2-(2-thienyl)acetyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide CAS Name: 1-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-5-(1-oxo-2-thiophen-2-ylethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide IUPAC Name: 1-methyl-N-(2-morpholin-4-ium-4-ylethyl)-5-(2-thiophen-2-ylacetyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide Traditional Name: 1-methyl-N-(2-morpholin-4-ium-4-ylethyl)-5-[2-(2-thienyl)acetyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide Formula: C20H28N5O3S+ MolecularWeight: 418.53302

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CN(CC2)C(=O)CC3=CC=CS3)C(=N1)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

CN1C2=C(CN(CC2)C(=O)CC3=CC=CS3)C(=N1)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C20H27N5O3S/c1-23-17-4-6-25(18(26)13-15-3-2-12-29-15)14-16(17)19(22-23)20(27)21-5-7-24-8-10-28-11-9-24/h2-3,12H,4-11,13-14H2,1H3,(H,21,27)/p+1