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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2C)SCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2C)SCCSC3=CC=C(C=C3)Cl

InChI

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