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

Systemtic Name: 3-[(4-hydroxyphenyl)methyl]-4-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-hydroxyphenyl)methyl]-4-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-hydroxyphenyl)methyl]-4-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-hydroxyphenyl)methyl]-4-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-hydroxybenzyl)-4-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2C(=NNC2=S)CC3=CC=C(C=C3)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2C(=NNC2=S)CC3=CC=C(C=C3)O

InChI

InChI=1S/C18H19N3O4S/c1-23-14-9-12(10-15(24-2)17(14)25-3)21-16(19-20-18(21)26)8-11-4-6-13(22)7-5-11/h4-7,9-10,22H,8H2,1-3H3,(H,20,26)