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

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-phenyl-2-pyrrolidino-ethyl)acetamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CSC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CSC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3OS2/c25-20(15-26-21-23-17-10-4-5-11-19(17)27-21)22-14-18(24-12-6-7-13-24)16-8-2-1-3-9-16/h1-5,8-11,18H,6-7,12-15H2,(H,22,25)