4-[5-[(2-chloranylquinolin-3-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]morpholine

Systemtic Name: 4-[5-[(2-chloranylquinolin-3-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[5-[(2-chloro-3-quinolyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[5-[(2-chloro-3-quinolinyl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[5-[(2-chloroquinolin-3-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[5-[(2-chloro-3-quinolyl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]morpholine Formula: C22H20ClN5OS MolecularWeight: 437.9451

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN=C(N2C3=CC=CC=C3)SCC4=CC5=CC=CC=C5N=C4Cl

Isomeric SMILES

C1COCCN1C2=NN=C(N2C3=CC=CC=C3)SCC4=CC5=CC=CC=C5N=C4Cl

InChI

InChI=1S/C22H20ClN5OS/c23-20-17(14-16-6-4-5-9-19(16)24-20)15-30-22-26-25-21(27-10-12-29-13-11-27)28(22)18-7-2-1-3-8-18/h1-9,14H,10-13,15H2