1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-1,2,3,4-tetrazole-5-thione Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-tetrazole-5-thione CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-tetrazole-5-thione IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2H-tetrazole-5-thione Traditional Name: 1-homoveratryl-2H-tetrazole-5-thione Formula: C11H14N4O2S MolecularWeight: 266.31946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=S)N=NN2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=S)N=NN2)OC

InChI

InChI=1S/C11H14N4O2S/c1-16-9-4-3-8(7-10(9)17-2)5-6-15-11(18)12-13-14-15/h3-4,7H,5-6H2,1-2H3,(H,12,14,18)