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

Systemtic Name: 3-[2-(4-chlorophenyl)sulfanylethylsulfanyl]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole Openeye Name: 3-[2-(4-chlorophenyl)sulfanylethylsulfanyl]-4-methyl-5-(o-tolyl)-1,2,4-triazole CAS Name: 3-[2-[(4-chlorophenyl)thio]ethylthio]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole IUPAC Name: 3-[2-(4-chlorophenyl)sulfanylethylsulfanyl]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole Traditional Name: 3-[2-[(4-chlorophenyl)thio]ethylthio]-4-methyl-5-(o-tolyl)-1,2,4-triazole Formula: C18H18ClN3S2 MolecularWeight: 375.93862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2C)SCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2C)SCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3S2/c1-13-5-3-4-6-16(13)17-20-21-18(22(17)2)24-12-11-23-15-9-7-14(19)8-10-15/h3-10H,11-12H2,1-2H3