3-[(4-chlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1,2,4-triazol-4-amine CAS Name: 3-[(4-chlorophenyl)methylthio]-5-(2-methoxyphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(4-chlorobenzyl)thio]-5-(2-methoxyphenyl)-1,2,4-triazol-4-yl]amine Formula: C16H15ClN4OS MolecularWeight: 346.8345

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2N)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2N)SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H15ClN4OS/c1-22-14-5-3-2-4-13(14)15-19-20-16(21(15)18)23-10-11-6-8-12(17)9-7-11/h2-9H,10,18H2,1H3