3-methylsulfonyl-N-[3-(2-phenylethynyl)phenyl]benzamide

Systemtic Name: 3-methylsulfonyl-N-[3-(2-phenylethynyl)phenyl]benzamide Openeye Name: 3-methylsulfonyl-N-[3-(2-phenylethynyl)phenyl]benzamide CAS Name: 3-methylsulfonyl-N-[3-(2-phenylethynyl)phenyl]benzamide IUPAC Name: 3-methylsulfonyl-N-[3-(2-phenylethynyl)phenyl]benzamide Traditional Name: 3-mesyl-N-[3-(2-phenylethynyl)phenyl]benzamide Formula: C22H17NO3S MolecularWeight: 375.44028

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C22H17NO3S/c1-27(25,26)21-12-6-10-19(16-21)22(24)23-20-11-5-9-18(15-20)14-13-17-7-3-2-4-8-17/h2-12,15-16H,1H3,(H,23,24)