2-methyl-2-[4-[1-(6-oxidanyl-1H-benzimidazol-2-yl)ethoxy]phenyl]propanethioic S-acid

Systemtic Name: 2-methyl-2-[4-[1-(6-oxidanyl-1H-benzimidazol-2-yl)ethoxy]phenyl]propanethioic S-acid Openeye Name: 2-[4-[1-(6-hydroxy-1H-benzimidazol-2-yl)ethoxy]phenyl]-2-methyl-propanethioic S-acid CAS Name: 2-[4-[1-(6-hydroxy-1H-benzimidazol-2-yl)ethoxy]phenyl]-2-methylpropanethioic S-acid IUPAC Name: 2-[4-[1-(6-hydroxy-1H-benzimidazol-2-yl)ethoxy]phenyl]-2-methylpropanethioic S-acid Traditional Name: 2-[4-[1-(6-hydroxy-1H-benzimidazol-2-yl)ethoxy]phenyl]-2-methyl-thiopropionic acid Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(N1)C=C(C=C2)O)OC3=CC=C(C=C3)C(C)(C)C(=O)S

Isomeric SMILES

CC(C1=NC2=C(N1)C=C(C=C2)O)OC3=CC=C(C=C3)C(C)(C)C(=O)S

InChI

InChI=1S/C19H20N2O3S/c1-11(17-20-15-9-6-13(22)10-16(15)21-17)24-14-7-4-12(5-8-14)19(2,3)18(23)25/h4-11,22H,1-3H3,(H,20,21)(H,23,25)