N-tert-butyl-2-[4-[2-[(2S)-2-methyl-5-sulfamoyl-2,3-dihydroindol-1-yl]ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[(2S)-2-methyl-5-sulfamoyl-2,3-dihydroindol-1-yl]ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[(2S)-2-methyl-5-sulfamoyl-indolin-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-[(2S)-2-methyl-5-sulfamoyl-2,3-dihydroindol-1-yl]-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-[(2S)-2-methyl-5-sulfamoyl-2,3-dihydroindol-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-[(2S)-2-methyl-5-sulfamoyl-indolin-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide Formula: C21H34N5O4S+ MolecularWeight: 452.59076

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1CC(=O)N3CC[NH+](CC3)CC(=O)NC(C)(C)C)C=CC(=C2)S(=O)(=O)N

Isomeric SMILES

C[C@H]1CC2=C(N1CC(=O)N3CC[NH+](CC3)CC(=O)NC(C)(C)C)C=CC(=C2)S(=O)(=O)N

InChI

InChI=1S/C21H33N5O4S/c1-15-11-16-12-17(31(22,29)30)5-6-18(16)26(15)14-20(28)25-9-7-24(8-10-25)13-19(27)23-21(2,3)4/h5-6,12,15H,7-11,13-14H2,1-4H3,(H,23,27)(H2,22,29,30)/p+1/t15-/m0/s1