3-(2,3-dihydroindol-1-ylsulfonyl)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 3-(2,3-dihydroindol-1-ylsulfonyl)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 3-indolin-1-ylsulfonyl-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]benzamide CAS Name: 3-(2,3-dihydroindol-1-ylsulfonyl)-N-[4-(1-piperidin-1-iumylmethyl)-2-thiazolyl]benzamide IUPAC Name: 3-(2,3-dihydroindol-1-ylsulfonyl)-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]benzamide Traditional Name: 3-indolin-1-ylsulfonyl-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]benzamide Formula: C24H27N4O3S2+ MolecularWeight: 483.62618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

C1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C24H26N4O3S2/c29-23(26-24-25-20(17-32-24)16-27-12-4-1-5-13-27)19-8-6-9-21(15-19)33(30,31)28-14-11-18-7-2-3-10-22(18)28/h2-3,6-10,15,17H,1,4-5,11-14,16H2,(H,25,26,29)/p+1