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

Systemtic Name: 3-[(5-methyl-4-nitroso-2-propan-2-yl-phenoxy)methyl]-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2-isopropyl-5-methyl-4-nitroso-phenoxy)methyl]-4-(p-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(5-methyl-4-nitroso-2-propan-2-ylphenoxy)methyl]-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(5-methyl-4-nitroso-2-propan-2-ylphenoxy)methyl]-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(2-isopropyl-5-methyl-4-nitroso-phenoxy)methyl]-4-(p-tolyl)-1H-1,2,4-triazole-5-thione Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NNC2=S)COC3=CC(=C(C=C3C(C)C)N=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NNC2=S)COC3=CC(=C(C=C3C(C)C)N=O)C

InChI

InChI=1S/C20H22N4O2S/c1-12(2)16-10-17(23-25)14(4)9-18(16)26-11-19-21-22-20(27)24(19)15-7-5-13(3)6-8-15/h5-10,12H,11H2,1-4H3,(H,22,27)