4-[4-ethyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-quinoline

Systemtic Name: 4-[4-ethyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-quinoline Openeye Name: 4-[4-ethyl-5-(3-pyridylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenyl-quinoline CAS Name: 4-[4-ethyl-5-(3-pyridinylmethylthio)-1,2,4-triazol-3-yl]-2-phenylquinoline IUPAC Name: 4-[4-ethyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-phenylquinoline Traditional Name: 4-[4-ethyl-5-(3-pyridylmethylthio)-1,2,4-triazol-3-yl]-2-phenyl-quinoline Formula: C25H21N5S MolecularWeight: 423.53274

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CN=CC=C2)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCN1C(=NN=C1SCC2=CN=CC=C2)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H21N5S/c1-2-30-24(28-29-25(30)31-17-18-9-8-14-26-16-18)21-15-23(19-10-4-3-5-11-19)27-22-13-7-6-12-20(21)22/h3-16H,2,17H2,1H3