2-[[1-(2,6-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-pentyl-ethanamide

Systemtic Name: 2-[[1-(2,6-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-pentyl-ethanamide Openeye Name: 2-[1-(2,6-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-pentyl-acetamide CAS Name: 2-[[1-(2,6-dimethylphenyl)-5-tetrazolyl]thio]-N-pentylacetamide IUPAC Name: 2-[1-(2,6-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-pentylacetamide Traditional Name: N-amyl-2-[[1-(2,6-dimethylphenyl)tetrazol-5-yl]thio]acetamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CSC1=NN=NN1C2=C(C=CC=C2C)C

Isomeric SMILES

CCCCCNC(=O)CSC1=NN=NN1C2=C(C=CC=C2C)C

InChI

InChI=1S/C16H23N5OS/c1-4-5-6-10-17-14(22)11-23-16-18-19-20-21(16)15-12(2)8-7-9-13(15)3/h7-9H,4-6,10-11H2,1-3H3,(H,17,22)