2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(3-ethynylphenyl)benzamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(3-ethynylphenyl)benzamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(3-ethynylphenyl)benzamide CAS Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-(3-ethynylphenyl)benzamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(3-ethynylphenyl)benzamide Traditional Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-(3-ethynylphenyl)benzamide Formula: C23H16N2O2S MolecularWeight: 384.45034

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C23H16N2O2S/c1-2-16-8-7-10-18(14-16)24-22(26)19-11-4-3-9-17(19)15-28-23-25-20-12-5-6-13-21(20)27-23/h1,3-14H,15H2,(H,24,26)