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1-[5-(5,6-Dimethoxy-1H-benzimidazol-1-yl)-3-{[2-(methylsulfonyl)benzyl]oxy}-2-thienyl]methanamine

ChemSpider ID: 21467814
Molecular Formula: C₂₂H₂₃N₃O₅S₂
Average mass: 473.565002 Da
Monoisotopic mass: 473.108002 Da
Systematic name

1-[5-(5,6-Dimethoxy-1H-benzimidazol-1-yl)-3-{[2-(methylsulfonyl)benzyl]oxy}-2-thienyl]methanamine
SMILES and InChIs

SMILES:

COc1cc2c(cc1OC)n(cn2)c3cc(c(s3)CN)OCc4ccccc4S(=O)(=O)C Copied

Std. InChI:

InChI=1S/C22H23N3O5S2/c1-28-17-8-15-16(9-18(17)29-2)25(13-24-15)22-10-19(20(11-23)31-22)30-12-14-6-4-5-7-21(14)32(3,26)27/h4-10,13H,11-12,23H2,1-3H3 Copied

Std. InChIKey:

NGRNBXRURVIWOR-UHFFFAOYSA-N Copied

Date of deprecation: 10:13, Dec 10, 2012
Reason for deprecation: Deprecate record: Erroneous deposition from one datasource (now removed, an other is not verifiable

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Common reasons for deprecation are:

Chemically impossible structures (eg. incorrect valence atoms)
Lack of any linking data sources
Poor depiction of a structure that is already in ChemSpider

Curation

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1-[5-(5,6-Dimethoxy-1H-benzimidazol-1-yl)-3-{[2-(methylsulfonyl)benzyl]oxy}-2-thienyl]methanamine

SMILES:

Std. InChI:

Std. InChIKey:

Curation

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