4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(4-ethanoylphenyl)benzamide

Systemtic Name: 4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(4-ethanoylphenyl)benzamide Openeye Name: N-(4-acetylphenyl)-4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide CAS Name: N-(4-acetylphenyl)-4-[[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-(4-acetylphenyl)-4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: N-(4-acetylphenyl)-4-[[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]methyl]benzamide Formula: C30H24N4O2S MolecularWeight: 504.60216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H24N4O2S/c1-21(35)23-16-18-26(19-17-23)31-29(36)25-14-12-22(13-15-25)20-37-30-33-32-28(24-8-4-2-5-9-24)34(30)27-10-6-3-7-11-27/h2-19H,20H2,1H3,(H,31,36)