2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide Formula: C25H20N2O2S2 MolecularWeight: 444.5685

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

InChI

InChI=1S/C25H20N2O2S2/c1-17-23(18(2)29-27-17)16-31-24-11-4-3-10-22(24)25(28)26-20-8-5-7-19(15-20)12-13-21-9-6-14-30-21/h3-11,14-15H,16H2,1-2H3,(H,26,28)