4-[2-(3,4-dimethoxyphenyl)ethyl]-3-thiophen-2-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-3-thiophen-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-thienyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-3-thiophen-2-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-3-thiophen-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-homoveratryl-3-(2-thienyl)-1H-1,2,4-triazole-5-thione Formula: C16H17N3O2S2 MolecularWeight: 347.45508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=NNC2=S)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=NNC2=S)C3=CC=CS3)OC

InChI

InChI=1S/C16H17N3O2S2/c1-20-12-6-5-11(10-13(12)21-2)7-8-19-15(17-18-16(19)22)14-4-3-9-23-14/h3-6,9-10H,7-8H2,1-2H3,(H,18,22)