3-methyl-4-[(3,4,5-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-methyl-4-[(3,4,5-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-methyl-4-[(3,4,5-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-methyl-4-[(3,4,5-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-methyl-4-[(3,4,5-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-methyl-4-[(3,4,5-trimethoxybenzyl)amino]-1H-1,2,4-triazole-5-thione Formula: C13H18N4O3S MolecularWeight: 310.37202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1NCC2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CC1=NNC(=S)N1NCC2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C13H18N4O3S/c1-8-15-16-13(21)17(8)14-7-9-5-10(18-2)12(20-4)11(6-9)19-3/h5-6,14H,7H2,1-4H3,(H,16,21)