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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSC1=NN=NN1C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCC(CC)NC(=O)CSC1=NN=NN1C2=CC(=C(C=C2)C)C

InChI

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