2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole

Systemtic Name: 2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Openeye Name: 2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole CAS Name: 2-[[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole IUPAC Name: 2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Traditional Name: 2-[[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole Formula: C18H16N4OS MolecularWeight: 336.41084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2C)SCC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2C)SCC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C18H16N4OS/c1-12-7-3-4-8-13(12)17-20-21-18(22(17)2)24-11-16-19-14-9-5-6-10-15(14)23-16/h3-10H,11H2,1-2H3