2-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinolin-5-yl-ethanamide

Systemtic Name: 2-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinolin-5-yl-ethanamide Openeye Name: 2-[1-(4-isopropylphenyl)tetrazol-5-yl]sulfanyl-N-(5-quinolyl)acetamide CAS Name: 2-[[1-(4-propan-2-ylphenyl)-5-tetrazolyl]thio]-N-(5-quinolinyl)acetamide IUPAC Name: 2-[1-(4-propan-2-ylphenyl)tetrazol-5-yl]sulfanyl-N-quinolin-5-ylacetamide Traditional Name: 2-[(1-p-cumenyltetrazol-5-yl)thio]-N-(5-quinolyl)acetamide Formula: C21H20N6OS MolecularWeight: 404.4881

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C21H20N6OS/c1-14(2)15-8-10-16(11-9-15)27-21(24-25-26-27)29-13-20(28)23-19-7-3-6-18-17(19)5-4-12-22-18/h3-12,14H,13H2,1-2H3,(H,23,28)