3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4-chlorophenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-chlorobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C9H9ClN4S MolecularWeight: 240.71256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN=CN2N)Cl

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN=CN2N)Cl

InChI

InChI=1S/C9H9ClN4S/c10-8-3-1-7(2-4-8)5-15-9-13-12-6-14(9)11/h1-4,6H,5,11H2