1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(2-phenylphenoxy)ethanone

Systemtic Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(2-phenylphenoxy)ethanone Openeye Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(2-phenylphenoxy)ethanone CAS Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-2-(2-phenylphenoxy)ethanone IUPAC Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(2-phenylphenoxy)ethanone Traditional Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-2-(2-phenylphenoxy)ethanone Formula: C25H22N2O2S MolecularWeight: 414.51938

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)COC2=CC=CC=C2C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)COC2=CC=CC=C2C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H22N2O2S/c28-24(17-29-22-14-6-4-11-19(22)18-9-2-1-3-10-18)27-16-8-13-21(27)25-26-20-12-5-7-15-23(20)30-25/h1-7,9-12,14-15,21H,8,13,16-17H2/t21-/m1/s1