4-ethyl-2-(morpholin-4-ylmethyl)-5-(2-phenylquinolin-4-yl)-1,2,4-triazole-3-thione

Systemtic Name: 4-ethyl-2-(morpholin-4-ylmethyl)-5-(2-phenylquinolin-4-yl)-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-2-(morpholinomethyl)-5-(2-phenyl-4-quinolyl)-1,2,4-triazole-3-thione CAS Name: 4-ethyl-2-(4-morpholinylmethyl)-5-(2-phenyl-4-quinolinyl)-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-2-(morpholin-4-ylmethyl)-5-(2-phenylquinolin-4-yl)-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-2-(morpholinomethyl)-5-(2-phenyl-4-quinolyl)-1,2,4-triazole-3-thione Formula: C24H25N5OS MolecularWeight: 431.5532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCOCC2)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCOCC2)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C24H25N5OS/c1-2-28-23(26-29(24(28)31)17-27-12-14-30-15-13-27)20-16-22(18-8-4-3-5-9-18)25-21-11-7-6-10-19(20)21/h3-11,16H,2,12-15,17H2,1H3