2-(2-hex-1-ynylphenyl)-N-phenyl-ethanethioamide

Systemtic Name: 2-(2-hex-1-ynylphenyl)-N-phenyl-ethanethioamide Openeye Name: 2-(2-hex-1-ynylphenyl)-N-phenyl-thioacetamide CAS Name: 2-(2-hex-1-ynylphenyl)-N-phenylethanethioamide IUPAC Name: 2-(2-hex-1-ynylphenyl)-N-phenylethanethioamide Traditional Name: 2-(2-hex-1-ynylphenyl)-N-phenyl-thioacetamide Formula: C20H21NS MolecularWeight: 307.45244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC=CC=C1CC(=S)NC2=CC=CC=C2

Isomeric SMILES

CCCCC#CC1=CC=CC=C1CC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C20H21NS/c1-2-3-4-6-11-17-12-9-10-13-18(17)16-20(22)21-19-14-7-5-8-15-19/h5,7-10,12-15H,2-4,16H2,1H3,(H,21,22)