2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-(2-phenyl-2-pyrrolidino-ethyl)acetamide Formula: C22H25N3OS2 MolecularWeight: 411.5834

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CSCC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CSCC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3OS2/c26-21(15-27-16-22-24-18-10-4-5-11-20(18)28-22)23-14-19(25-12-6-7-13-25)17-8-2-1-3-9-17/h1-5,8-11,19H,6-7,12-16H2,(H,23,26)