3-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine Openeye Name: 3-[(2,6-dichlorophenyl)methylsulfanyl]-5-(3-pyridyl)-1,2,4-triazol-4-amine CAS Name: 3-[(2,6-dichlorophenyl)methylthio]-5-(3-pyridinyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(2,6-dichlorophenyl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine Traditional Name: [3-[(2,6-dichlorobenzyl)thio]-5-(3-pyridyl)-1,2,4-triazol-4-yl]amine Formula: C14H11Cl2N5S MolecularWeight: 352.24164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=NN=C(N2N)C3=CN=CC=C3)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=NN=C(N2N)C3=CN=CC=C3)Cl

InChI

InChI=1S/C14H11Cl2N5S/c15-11-4-1-5-12(16)10(11)8-22-14-20-19-13(21(14)17)9-3-2-6-18-7-9/h1-7H,8,17H2