(4-acetamidonaphthalen-1-yl) 6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazole-5-sulfonate

Systemtic Name: (4-acetamidonaphthalen-1-yl) 6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazole-5-sulfonate Openeye Name: (4-acetamido-1-naphthyl) 6-methyl-2-oxo-1,3-dihydrobenzimidazole-5-sulfonate CAS Name: 6-methyl-2-oxo-1,3-dihydrobenzimidazole-5-sulfonic acid (4-acetamido-1-naphthalenyl) ester IUPAC Name: (4-acetamidonaphthalen-1-yl) 6-methyl-2-oxo-1,3-dihydrobenzimidazole-5-sulfonate Traditional Name: 2-keto-6-methyl-1,3-dihydrobenzimidazole-5-sulfonic acid (4-acetamido-1-naphthyl) ester Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)OC3=CC=C(C4=CC=CC=C43)NC(=O)C)NC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)OC3=CC=C(C4=CC=CC=C43)NC(=O)C)NC(=O)N2

InChI

InChI=1S/C20H17N3O5S/c1-11-9-16-17(23-20(25)22-16)10-19(11)29(26,27)28-18-8-7-15(21-12(2)24)13-5-3-4-6-14(13)18/h3-10H,1-2H3,(H,21,24)(H2,22,23,25)