6-(ethylsulfonylamino)-3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-2-phenyl-benzimidazole-4-carboxamide

Systemtic Name: 6-(ethylsulfonylamino)-3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-2-phenyl-benzimidazole-4-carboxamide Openeye Name: 6-(ethylsulfonylamino)-3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-2-phenyl-benzimidazole-4-carboxamide CAS Name: 6-(ethylsulfonylamino)-3-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-2-phenyl-4-benzimidazolecarboxamide IUPAC Name: 6-(ethylsulfonylamino)-3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-2-phenylbenzimidazole-4-carboxamide Traditional Name: 6-(esylamino)-3-methyl-N-(2-morpholin-4-ium-4-ylethyl)-2-phenyl-benzimidazole-4-carboxamide Formula: C23H30N5O4S+ MolecularWeight: 472.5804

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC2=C(C(=C1)C(=O)NCC[NH+]3CCOCC3)N(C(=N2)C4=CC=CC=C4)C

Isomeric SMILES

CCS(=O)(=O)NC1=CC2=C(C(=C1)C(=O)NCC[NH+]3CCOCC3)N(C(=N2)C4=CC=CC=C4)C

InChI

InChI=1S/C23H29N5O4S/c1-3-33(30,31)26-18-15-19(23(29)24-9-10-28-11-13-32-14-12-28)21-20(16-18)25-22(27(21)2)17-7-5-4-6-8-17/h4-8,15-16,26H,3,9-14H2,1-2H3,(H,24,29)/p+1