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

Systemtic Name: 2-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinolin-5-yl-propanamide Openeye Name: 2-[1-(4-isopropylphenyl)tetrazol-5-yl]sulfanyl-N-(5-quinolyl)propanamide CAS Name: 2-[[1-(4-propan-2-ylphenyl)-5-tetrazolyl]thio]-N-(5-quinolinyl)propanamide IUPAC Name: 2-[1-(4-propan-2-ylphenyl)tetrazol-5-yl]sulfanyl-N-quinolin-5-ylpropanamide Traditional Name: 2-[(1-p-cumenyltetrazol-5-yl)thio]-N-(5-quinolyl)propionamide Formula: C22H22N6OS MolecularWeight: 418.51468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N6OS/c1-14(2)16-9-11-17(12-10-16)28-22(25-26-27-28)30-15(3)21(29)24-20-8-4-7-19-18(20)6-5-13-23-19/h4-15H,1-3H3,(H,24,29)