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

Systemtic Name: N-(3,5-dimethylphenyl)-2-[(1-pyridin-3-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-[1-(3-pyridyl)tetrazol-5-yl]sulfanyl-acetamide CAS Name: N-(3,5-dimethylphenyl)-2-[[1-(3-pyridinyl)-5-tetrazolyl]thio]acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(1-pyridin-3-yltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(3,5-dimethylphenyl)-2-[[1-(3-pyridyl)tetrazol-5-yl]thio]acetamide Formula: C16H16N6OS MolecularWeight: 340.40284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CSC2=NN=NN2C3=CN=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CSC2=NN=NN2C3=CN=CC=C3)C

InChI

InChI=1S/C16H16N6OS/c1-11-6-12(2)8-13(7-11)18-15(23)10-24-16-19-20-21-22(16)14-4-3-5-17-9-14/h3-9H,10H2,1-2H3,(H,18,23)