methyl 3-[4-[[6-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-1-methyl-benzimidazol-2-yl]methoxy]phenyl]-2-oxidanyl-propanoate

Systemtic Name: methyl 3-[4-[[6-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-1-methyl-benzimidazol-2-yl]methoxy]phenyl]-2-oxidanyl-propanoate Openeye Name: methyl 3-[4-[[6-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-1-methyl-benzimidazol-2-yl]methoxy]phenyl]-2-hydroxy-propanoate CAS Name: 3-[4-[[6-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-1-methyl-2-benzimidazolyl]methoxy]phenyl]-2-hydroxypropanoic acid methyl ester IUPAC Name: methyl 3-[4-[[6-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl-1-methylbenzimidazol-2-yl]methoxy]phenyl]-2-hydroxypropanoate Traditional Name: 3-[4-[[6-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-1-methyl-benzimidazol-2-yl]methoxy]phenyl]-2-hydroxy-propionic acid methyl ester Formula: C33H40N2O5S MolecularWeight: 576.7461

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2=CC3=C(C=C2)N=C(N3C)COC4=CC=C(C=C4)CC(C(=O)OC)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2=CC3=C(C=C2)N=C(N3C)COC4=CC=C(C=C4)CC(C(=O)OC)O

InChI

InChI=1S/C33H40N2O5S/c1-32(2,3)24-16-23(17-25(30(24)37)33(4,5)6)41-22-13-14-26-27(18-22)35(7)29(34-26)19-40-21-11-9-20(10-12-21)15-28(36)31(38)39-8/h9-14,16-18,28,36-37H,15,19H2,1-8H3