3-[(5-chloranylquinolin-8-yl)methylsulfanyl]-5-(3-chlorophenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(5-chloranylquinolin-8-yl)methylsulfanyl]-5-(3-chlorophenyl)-1,2,4-triazol-4-amine Openeye Name: 3-(3-chlorophenyl)-5-[(5-chloro-8-quinolyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(3-chlorophenyl)-5-[(5-chloro-8-quinolinyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(3-chlorophenyl)-5-[(5-chloroquinolin-8-yl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(3-chlorophenyl)-5-[(5-chloro-8-quinolyl)methylthio]-1,2,4-triazol-4-yl]amine Formula: C18H13Cl2N5S MolecularWeight: 402.30032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=NN=C(N2N)SCC3=C4C(=C(C=C3)Cl)C=CC=N4

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=NN=C(N2N)SCC3=C4C(=C(C=C3)Cl)C=CC=N4

InChI

InChI=1S/C18H13Cl2N5S/c19-13-4-1-3-11(9-13)17-23-24-18(25(17)21)26-10-12-6-7-15(20)14-5-2-8-22-16(12)14/h1-9H,10,21H2