3-(2,4-dichlorophenyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(2,4-dichlorophenyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-(2,4-dichlorophenyl)-5-(4-pyridylmethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-(2,4-dichlorophenyl)-5-(pyridin-4-ylmethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-(2,4-dichlorophenyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-(2,4-dichlorophenyl)-5-(4-pyridylmethylthio)-1,2,4-triazol-4-yl]amine Formula: C14H11Cl2N5S MolecularWeight: 352.24164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C2=NN=C(N2N)SCC3=CC=NC=C3

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C2=NN=C(N2N)SCC3=CC=NC=C3

InChI

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