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

Systemtic Name: 4-(2,2-dimethoxyethyl)-3-[[(4-methoxyphenyl)amino]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2,2-dimethoxyethyl)-3-[(4-methoxyanilino)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,2-dimethoxyethyl)-3-[(4-methoxyanilino)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2,2-dimethoxyethyl)-3-[(4-methoxyanilino)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2,2-dimethoxyethyl)-3-(p-anisidinomethyl)-1H-1,2,4-triazole-5-thione Formula: C14H20N4O3S MolecularWeight: 324.3986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NCC2=NNC(=S)N2CC(OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)NCC2=NNC(=S)N2CC(OC)OC

InChI

InChI=1S/C14H20N4O3S/c1-19-11-6-4-10(5-7-11)15-8-12-16-17-14(22)18(12)9-13(20-2)21-3/h4-7,13,15H,8-9H2,1-3H3,(H,17,22)