5-[(3-methyl-4-propan-2-yl-phenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione

Systemtic Name: 5-[(3-methyl-4-propan-2-yl-phenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione Openeye Name: 5-[(4-isopropyl-3-methyl-phenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione CAS Name: 5-[(3-methyl-4-propan-2-ylphenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione IUPAC Name: 5-[(3-methyl-4-propan-2-ylphenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione Traditional Name: 5-[(4-isopropyl-3-methyl-phenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC(=S)NN2)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC(=S)NN2)C(C)C

InChI

InChI=1S/C13H17N3OS/c1-8(2)11-5-4-10(6-9(11)3)17-7-12-14-13(18)16-15-12/h4-6,8H,7H2,1-3H3,(H2,14,15,16,18)