[2-methyl-5-[4-(2-sulfonylethylamino)phenyl]sulfonyloxy-benzimidazol-2-yl]carbamic acid

Systemtic Name: [2-methyl-5-[4-(2-sulfonylethylamino)phenyl]sulfonyloxy-benzimidazol-2-yl]carbamic acid Openeye Name: [2-methyl-5-[4-(2-sulfonylethylamino)phenyl]sulfonyloxy-benzimidazol-2-yl]carbamic acid CAS Name: [2-methyl-5-[4-(2-sulfonylethylamino)phenyl]sulfonyloxy-2-benzimidazolyl]carbamic acid IUPAC Name: [2-methyl-5-[4-(2-sulfonylethylamino)phenyl]sulfonyloxybenzimidazol-2-yl]carbamic acid Traditional Name: [2-methyl-5-[4-(2-sulfonylethylamino)phenyl]sulfonyloxy-benzimidazol-2-yl]carbamic acid Formula: C17H16N4O7S2 MolecularWeight: 452.46154

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C2C=CC(=CC2=N1)OS(=O)(=O)C3=CC=C(C=C3)NCC=S(=O)=O)NC(=O)O

Isomeric SMILES

CC1(N=C2C=CC(=CC2=N1)OS(=O)(=O)C3=CC=C(C=C3)NCC=S(=O)=O)NC(=O)O

InChI

InChI=1S/C17H16N4O7S2/c1-17(21-16(22)23)19-14-7-4-12(10-15(14)20-17)28-30(26,27)13-5-2-11(3-6-13)18-8-9-29(24)25/h2-7,9-10,18,21H,8H2,1H3,(H,22,23)