2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanylmethyl]-1,3-benzoxazole

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanylmethyl]-1,3-benzoxazole Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanylmethyl]-1,3-benzoxazole CAS Name: 2-[[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]methyl]-1,3-benzoxazole IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanylmethyl]-1,3-benzoxazole Traditional Name: 2-[[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]methyl]-1,3-benzoxazole Formula: C23H16N4OS MolecularWeight: 396.46434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=NC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=NC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C23H16N4OS/c1-3-9-16(10-4-1)21-22(17-11-5-2-6-12-17)26-27-23(25-21)29-15-20-24-18-13-7-8-14-19(18)28-20/h1-14H,15H2