2-[[bis(2-methylpropyl)amino]methyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-[[bis(2-methylpropyl)amino]methyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-[(diisobutylamino)methyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[bis(2-methylpropyl)amino]methyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[bis(2-methylpropyl)amino]methyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-[(diisobutylamino)methyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione Formula: C18H28N4OS MolecularWeight: 348.50612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)CN1C(=S)N=C(N1)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CN(CC(C)C)CN1C(=S)N=C(N1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H28N4OS/c1-13(2)10-21(11-14(3)4)12-22-18(24)19-17(20-22)15-6-8-16(23-5)9-7-15/h6-9,13-14H,10-12H2,1-5H3,(H,19,20,24)