N-(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-2-(4-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-2-(4-methylphenyl)sulfanyl-ethanamide Openeye Name: N-(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-2-(p-tolylsulfanyl)acetamide CAS Name: N-[4-(2-benzo[f][1,3]benzoxazolyl)phenyl]-2-[(4-methylphenyl)thio]acetamide IUPAC Name: N-(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-2-(4-methylphenyl)sulfanylacetamide Traditional Name: N-(4-benzo[f][1,3]benzoxazol-2-ylphenyl)-2-(p-tolylthio)acetamide Formula: C26H20N2O2S MolecularWeight: 424.5142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=CC=C(C=C2)C3=NC4=CC5=CC=CC=C5C=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=CC=C(C=C2)C3=NC4=CC5=CC=CC=C5C=C4O3

InChI

InChI=1S/C26H20N2O2S/c1-17-6-12-22(13-7-17)31-16-25(29)27-21-10-8-18(9-11-21)26-28-23-14-19-4-2-3-5-20(19)15-24(23)30-26/h2-15H,16H2,1H3,(H,27,29)