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

Systemtic Name: 2-[(6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyl-propyl-amino]benzoic acid Openeye Name: 2-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl-propyl-amino]benzoic acid CAS Name: 2-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl-propylamino]benzoic acid IUPAC Name: 2-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl-propylamino]benzoic acid Traditional Name: 2-[(2-keto-6-methyl-1,3-dihydrobenzimidazol-5-yl)sulfonyl-propyl-amino]benzoic acid Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O5S/c1-3-8-21(15-7-5-4-6-12(15)17(22)23)27(25,26)16-10-14-13(9-11(16)2)19-18(24)20-14/h4-7,9-10H,3,8H2,1-2H3,(H,22,23)(H2,19,20,24)