3-(4-tert-butylphenyl)-5-[2-(4-chlorophenyl)sulfanylethylsulfanyl]-4-methyl-1,2,4-triazole

Systemtic Name: 3-(4-tert-butylphenyl)-5-[2-(4-chlorophenyl)sulfanylethylsulfanyl]-4-methyl-1,2,4-triazole Openeye Name: 3-(4-tert-butylphenyl)-5-[2-(4-chlorophenyl)sulfanylethylsulfanyl]-4-methyl-1,2,4-triazole CAS Name: 3-(4-tert-butylphenyl)-5-[2-[(4-chlorophenyl)thio]ethylthio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(4-tert-butylphenyl)-5-[2-(4-chlorophenyl)sulfanylethylsulfanyl]-4-methyl-1,2,4-triazole Traditional Name: 3-(4-tert-butylphenyl)-5-[2-[(4-chlorophenyl)thio]ethylthio]-4-methyl-1,2,4-triazole Formula: C21H24ClN3S2 MolecularWeight: 418.01836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H24ClN3S2/c1-21(2,3)16-7-5-15(6-8-16)19-23-24-20(25(19)4)27-14-13-26-18-11-9-17(22)10-12-18/h5-12H,13-14H2,1-4H3