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

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

Systemtic Name:3-[[1-(3,5-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanenitrile
Openeye Name:3-[1-(3,5-dimethylphenyl)tetrazol-5-yl]sulfanylpropanenitrile
CAS Name:3-[[1-(3,5-dimethylphenyl)-5-tetrazolyl]thio]propanenitrile
IUPAC Name:3-[1-(3,5-dimethylphenyl)tetrazol-5-yl]sulfanylpropanenitrile
Traditional Name:3-[[1-(3,5-dimethylphenyl)tetrazol-5-yl]thio]propionitrile
Formula: C12H13N5S
MolecularWeight: 259.33012
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=NN=N2)SCCC#N)C


Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=NN=N2)SCCC#N)C


InChI

InChI=1S/C12H13N5S/c1-9-6-10(2)8-11(7-9)17-12(14-15-16-17)18-5-3-4-13/h6-8H,3,5H2,1-2H3


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