3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-(o-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-[(2-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-[(2-methylbenzyl)thio]-1,2,4-triazole Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2C)C3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C19H19N3O2S/c1-13-7-3-4-8-14(13)12-25-19-21-20-18(22(19)2)17-11-23-15-9-5-6-10-16(15)24-17/h3-10,17H,11-12H2,1-2H3