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

Systemtic Name: 2-[[1-(oxolan-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinolin-5-yl-propanamide Openeye Name: N-(5-quinolyl)-2-[1-(tetrahydrofuran-2-ylmethyl)tetrazol-5-yl]sulfanyl-propanamide CAS Name: 2-[[1-(2-oxolanylmethyl)-5-tetrazolyl]thio]-N-(5-quinolinyl)propanamide IUPAC Name: 2-[1-(oxolan-2-ylmethyl)tetrazol-5-yl]sulfanyl-N-quinolin-5-ylpropanamide Traditional Name: N-(5-quinolyl)-2-[[1-(tetrahydrofurfuryl)tetrazol-5-yl]thio]propionamide Formula: C18H20N6O2S MolecularWeight: 384.4554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)SC3=NN=NN3CC4CCCO4

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)SC3=NN=NN3CC4CCCO4

InChI

InChI=1S/C18H20N6O2S/c1-12(27-18-21-22-23-24(18)11-13-5-4-10-26-13)17(25)20-16-8-2-7-15-14(16)6-3-9-19-15/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,20,25)