3-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[(5-chloro-1,3-dimethylpyrazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C8H11ClN6S MolecularWeight: 258.73114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=NNC(=N2)N)Cl)C

Isomeric SMILES

CC1=NN(C(=C1CSC2=NNC(=N2)N)Cl)C

InChI

InChI=1S/C8H11ClN6S/c1-4-5(6(9)15(2)14-4)3-16-8-11-7(10)12-13-8/h3H2,1-2H3,(H3,10,11,12,13)