(5S)-1-methyl-5-(4-methylpiperidin-1-ium-1-yl)-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: (5S)-1-methyl-5-(4-methylpiperidin-1-ium-1-yl)-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: (5S)-1-methyl-5-(4-methylpiperidin-1-ium-1-yl)-N-(2-thienylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: (5S)-1-methyl-5-(4-methyl-1-piperidin-1-iumyl)-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: (5S)-1-methyl-5-(4-methylpiperidin-1-ium-1-yl)-N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: (5S)-1-methyl-5-(4-methylpiperidin-1-ium-1-yl)-N-(2-thenyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C20H29N4OS+ MolecularWeight: 373.53546

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C2CCC3=C(C2)C(=NN3C)C(=O)NCC4=CC=CS4

Isomeric SMILES

CC1CC[NH+](CC1)[C@H]2CCC3=C(C2)C(=NN3C)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C20H28N4OS/c1-14-7-9-24(10-8-14)15-5-6-18-17(12-15)19(22-23(18)2)20(25)21-13-16-4-3-11-26-16/h3-4,11,14-15H,5-10,12-13H2,1-2H3,(H,21,25)/p+1/t15-/m0/s1