N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-4-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]-4-(4-thiazolylmethylthio)benzamide IUPAC Name: N-(2-phenyl-2-pyrrolidin-1-ylethyl)-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-(2-phenyl-2-pyrrolidino-ethyl)-4-(thiazol-4-ylmethylthio)benzamide Formula: C23H25N3OS2 MolecularWeight: 423.5941

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC=C(C=C2)SCC3=CSC=N3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC=C(C=C2)SCC3=CSC=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS2/c27-23(19-8-10-21(11-9-19)29-16-20-15-28-17-25-20)24-14-22(26-12-4-5-13-26)18-6-2-1-3-7-18/h1-3,6-11,15,17,22H,4-5,12-14,16H2,(H,24,27)