2-[butyl-[(6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]benzoic acid

Systemtic Name: 2-[butyl-[(6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]benzoic acid Openeye Name: 2-[butyl-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]benzoic acid CAS Name: 2-[butyl-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]benzoic acid IUPAC Name: 2-[butyl-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]benzoic acid Traditional Name: 2-[butyl-[(2-keto-6-methyl-1,3-dihydrobenzimidazol-5-yl)sulfonyl]amino]benzoic acid Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1C(=O)O)S(=O)(=O)C2=CC3=C(C=C2C)NC(=O)N3

Isomeric SMILES

CCCCN(C1=CC=CC=C1C(=O)O)S(=O)(=O)C2=CC3=C(C=C2C)NC(=O)N3

InChI

InChI=1S/C19H21N3O5S/c1-3-4-9-22(16-8-6-5-7-13(16)18(23)24)28(26,27)17-11-15-14(10-12(17)2)20-19(25)21-15/h5-8,10-11H,3-4,9H2,1-2H3,(H,23,24)(H2,20,21,25)