2-[[1-(2-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanenitrile

Systemtic Name: 2-[[1-(2-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanenitrile Openeye Name: 2-[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanylpropanenitrile CAS Name: 2-[[1-(2-ethoxyphenyl)-5-tetrazolyl]thio]propanenitrile IUPAC Name: 2-[1-(2-ethoxyphenyl)tetrazol-5-yl]sulfanylpropanenitrile Traditional Name: 2-[(1-o-phenetyltetrazol-5-yl)thio]propionitrile Formula: C12H13N5OS MolecularWeight: 275.32952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=NN=N2)SC(C)C#N

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=NN=N2)SC(C)C#N

InChI

InChI=1S/C12H13N5OS/c1-3-18-11-7-5-4-6-10(11)17-12(14-15-16-17)19-9(2)8-13/h4-7,9H,3H2,1-2H3