3-[(2-chloranylquinolin-3-yl)methylsulfanyl]-5-[(4-fluoranylphenoxy)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(2-chloranylquinolin-3-yl)methylsulfanyl]-5-[(4-fluoranylphenoxy)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(2-chloro-3-quinolyl)methylsulfanyl]-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-4-amine CAS Name: 3-[(2-chloro-3-quinolinyl)methylthio]-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-chloroquinolin-3-yl)methylsulfanyl]-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(2-chloro-3-quinolyl)methylthio]-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-4-yl]amine Formula: C19H15ClFN5OS MolecularWeight: 415.871703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSC3=NN=C(N3N)COC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSC3=NN=C(N3N)COC4=CC=C(C=C4)F

InChI

InChI=1S/C19H15ClFN5OS/c20-18-13(9-12-3-1-2-4-16(12)23-18)11-28-19-25-24-17(26(19)22)10-27-15-7-5-14(21)6-8-15/h1-9H,10-11,22H2