2-[[1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinolin-5-yl-propanamide

Systemtic Name: 2-[[1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-quinolin-5-yl-propanamide Openeye Name: 2-[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]sulfanyl-N-(5-quinolyl)propanamide CAS Name: 2-[[1-(2-methoxy-5-methylphenyl)-5-tetrazolyl]thio]-N-(5-quinolinyl)propanamide IUPAC Name: 2-[1-(2-methoxy-5-methylphenyl)tetrazol-5-yl]sulfanyl-N-quinolin-5-ylpropanamide Traditional Name: 2-[[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]thio]-N-(5-quinolyl)propionamide Formula: C21H20N6O2S MolecularWeight: 420.4875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SC(C)C(=O)NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SC(C)C(=O)NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C21H20N6O2S/c1-13-9-10-19(29-3)18(12-13)27-21(24-25-26-27)30-14(2)20(28)23-17-8-4-7-16-15(17)6-5-11-22-16/h4-12,14H,1-3H3,(H,23,28)