2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(2-phenoxyphenyl)ethanamide

Systemtic Name: 2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(2-phenoxyphenyl)ethanamide Openeye Name: 2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(2-phenoxyphenyl)acetamide CAS Name: 2-[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-N-(2-phenoxyphenyl)acetamide IUPAC Name: 2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-(2-phenoxyphenyl)acetamide Traditional Name: 2-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-N-(2-phenoxyphenyl)acetamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC(=O)NC2=CC=CC=C2OC3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@H](N(C1)CC(=O)NC2=CC=CC=C2OC3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H23N3O2S/c29-24(26-19-11-4-6-14-22(19)30-18-9-2-1-3-10-18)17-28-16-8-13-21(28)25-27-20-12-5-7-15-23(20)31-25/h1-7,9-12,14-15,21H,8,13,16-17H2,(H,26,29)/t21-/m0/s1