2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-2-phenyl-ethanoic acid Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-2-phenyl-acetic acid CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-2-phenylacetic acid IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-2-phenylacetic acid Traditional Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-2-phenyl-acetic acid Formula: C23H17N3O2S MolecularWeight: 399.46498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)SC(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)SC(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H17N3O2S/c27-22(28)21(18-14-8-3-9-15-18)29-23-24-19(16-10-4-1-5-11-16)20(25-26-23)17-12-6-2-7-13-17/h1-15,21H,(H,27,28)