N-[3-(2-pyridin-2-ylethynyl)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-[3-(2-pyridin-2-ylethynyl)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-[3-[2-(2-pyridyl)ethynyl]phenyl]-2-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-2-(4-thiazolylmethylthio)benzamide IUPAC Name: N-[3-(2-pyridin-2-ylethynyl)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-[3-[2-(2-pyridyl)ethynyl]phenyl]-2-(thiazol-4-ylmethylthio)benzamide Formula: C24H17N3OS2 MolecularWeight: 427.54128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3)SCC4=CSC=N4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3)SCC4=CSC=N4

InChI

InChI=1S/C24H17N3OS2/c28-24(22-9-1-2-10-23(22)30-16-21-15-29-17-26-21)27-20-8-5-6-18(14-20)11-12-19-7-3-4-13-25-19/h1-10,13-15,17H,16H2,(H,27,28)