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

Systemtic Name: 2-(1,3-thiazol-4-ylmethylsulfanyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Openeye Name: 2-(thiazol-4-ylmethylsulfanyl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide CAS Name: 2-(4-thiazolylmethylthio)-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide IUPAC Name: 2-(1,3-thiazol-4-ylmethylsulfanyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Traditional Name: 2-(thiazol-4-ylmethylthio)-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide Formula: C23H16N2OS3 MolecularWeight: 432.58094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)SCC4=CSC=N4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)SCC4=CSC=N4

InChI

InChI=1S/C23H16N2OS3/c26-23(21-8-1-2-9-22(21)29-15-19-14-27-16-24-19)25-18-6-3-5-17(13-18)10-11-20-7-4-12-28-20/h1-9,12-14,16H,15H2,(H,25,26)