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

Systemtic Name: 4-[[5-(3-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(4-ethanoylphenyl)benzamide Openeye Name: N-(4-acetylphenyl)-4-[[5-(3-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide CAS Name: N-(4-acetylphenyl)-4-[[[5-(3-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]benzamide IUPAC Name: N-(4-acetylphenyl)-4-[[5-(3-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Traditional Name: N-(4-acetylphenyl)-4-[[[5-(3-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]benzamide Formula: C30H25N5O2S MolecularWeight: 519.6168

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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)N

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)N

InChI

InChI=1S/C30H25N5O2S/c1-20(36)22-14-16-26(17-15-22)32-29(37)23-12-10-21(11-13-23)19-38-30-34-33-28(24-6-5-7-25(31)18-24)35(30)27-8-3-2-4-9-27/h2-18H,19,31H2,1H3,(H,32,37)