4-(3,5-dimethoxyphenyl)-3-(naphthalen-1-yloxymethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3,5-dimethoxyphenyl)-3-(naphthalen-1-yloxymethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3,5-dimethoxyphenyl)-3-(1-naphthyloxymethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(3,5-dimethoxyphenyl)-3-(1-naphthalenyloxymethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3,5-dimethoxyphenyl)-3-(naphthalen-1-yloxymethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3,5-dimethoxyphenyl)-3-(1-naphthoxymethyl)-1H-1,2,4-triazole-5-thione Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2C(=NNC2=S)COC3=CC=CC4=CC=CC=C43)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2C(=NNC2=S)COC3=CC=CC4=CC=CC=C43)OC

InChI

InChI=1S/C21H19N3O3S/c1-25-16-10-15(11-17(12-16)26-2)24-20(22-23-21(24)28)13-27-19-9-5-7-14-6-3-4-8-18(14)19/h3-12H,13H2,1-2H3,(H,23,28)