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

Systemtic Name: 2-[[1-(3,4-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-hexyl-ethanamide Openeye Name: 2-[1-(3,4-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-hexyl-acetamide CAS Name: 2-[[1-(3,4-dimethylphenyl)-5-tetrazolyl]thio]-N-hexylacetamide IUPAC Name: 2-[1-(3,4-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-hexylacetamide Traditional Name: 2-[[1-(3,4-dimethylphenyl)tetrazol-5-yl]thio]-N-hexyl-acetamide Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CSC1=NN=NN1C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCCCCCNC(=O)CSC1=NN=NN1C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C17H25N5OS/c1-4-5-6-7-10-18-16(23)12-24-17-19-20-21-22(17)15-9-8-13(2)14(3)11-15/h8-9,11H,4-7,10,12H2,1-3H3,(H,18,23)