3-[2,4-bis(oxidanyl)-5-(phenylmethyl)phenyl]-6-methylsulfonyl-1H-benzimidazol-2-one

Systemtic Name: 3-[2,4-bis(oxidanyl)-5-(phenylmethyl)phenyl]-6-methylsulfonyl-1H-benzimidazol-2-one Openeye Name: 3-(5-benzyl-2,4-dihydroxy-phenyl)-6-methylsulfonyl-1H-benzimidazol-2-one CAS Name: 3-[2,4-dihydroxy-5-(phenylmethyl)phenyl]-6-methylsulfonyl-1H-benzimidazol-2-one IUPAC Name: 3-(5-benzyl-2,4-dihydroxyphenyl)-6-methylsulfonyl-1H-benzimidazol-2-one Traditional Name: 3-(5-benzyl-2,4-dihydroxy-phenyl)-6-mesyl-1H-benzimidazol-2-one Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N(C(=O)N2)C3=C(C=C(C(=C3)CC4=CC=CC=C4)O)O

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N(C(=O)N2)C3=C(C=C(C(=C3)CC4=CC=CC=C4)O)O

InChI

InChI=1S/C21H18N2O5S/c1-29(27,28)15-7-8-17-16(11-15)22-21(26)23(17)18-10-14(19(24)12-20(18)25)9-13-5-3-2-4-6-13/h2-8,10-12,24-25H,9H2,1H3,(H,22,26)