2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2,6-dimethoxy-phenoxy]ethanamide

Systemtic Name: 2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2,6-dimethoxy-phenoxy]ethanamide Openeye Name: 2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2,6-dimethoxy-phenoxy]acetamide CAS Name: 2-[4-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-2,6-dimethoxyphenoxy]acetamide IUPAC Name: 2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2,6-dimethoxyphenoxy]acetamide Traditional Name: 2-[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2,6-dimethoxy-phenoxy]acetamide Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC(=O)N)OC)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC(=CC(=C1OCC(=O)N)OC)C(=O)N2CCC[C@H]2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H23N3O5S/c1-28-16-10-13(11-17(29-2)20(16)30-12-19(23)26)22(27)25-9-5-7-15(25)21-24-14-6-3-4-8-18(14)31-21/h3-4,6,8,10-11,15H,5,7,9,12H2,1-2H3,(H2,23,26)/t15-/m0/s1