N-[2-[2-(2-methoxy-4-methyl-3-sulfanyl-phenyl)-3H-benzimidazol-5-yl]-2-methyl-propyl]methanesulfonamide

Systemtic Name: N-[2-[2-(2-methoxy-4-methyl-3-sulfanyl-phenyl)-3H-benzimidazol-5-yl]-2-methyl-propyl]methanesulfonamide Openeye Name: N-[2-[2-(2-methoxy-4-methyl-3-sulfanyl-phenyl)-3H-benzimidazol-5-yl]-2-methyl-propyl]methanesulfonamide CAS Name: N-[2-[2-(3-mercapto-2-methoxy-4-methylphenyl)-3H-benzimidazol-5-yl]-2-methylpropyl]methanesulfonamide IUPAC Name: N-[2-[2-(2-methoxy-4-methyl-3-sulfanylphenyl)-3H-benzimidazol-5-yl]-2-methylpropyl]methanesulfonamide Traditional Name: N-[2-[2-(3-mercapto-2-methoxy-4-methyl-phenyl)-3H-benzimidazol-5-yl]-2-methyl-propyl]methanesulfonamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(C)(C)CNS(=O)(=O)C)OC)S

Isomeric SMILES

CC1=C(C(=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(C)(C)CNS(=O)(=O)C)OC)S

InChI

InChI=1S/C20H25N3O3S2/c1-12-6-8-14(17(26-4)18(12)27)19-22-15-9-7-13(10-16(15)23-19)20(2,3)11-21-28(5,24)25/h6-10,21,27H,11H2,1-5H3,(H,22,23)