3-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole

Systemtic Name: 3-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole Openeye Name: 3-[(5-chloro-2-methoxy-phenyl)methylsulfanyl]-4-methyl-5-(o-tolyl)-1,2,4-triazole CAS Name: 3-[(5-chloro-2-methoxyphenyl)methylthio]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole IUPAC Name: 3-[(5-chloro-2-methoxyphenyl)methylsulfanyl]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole Traditional Name: 3-[(5-chloro-2-methoxy-benzyl)thio]-4-methyl-5-(o-tolyl)-1,2,4-triazole Formula: C18H18ClN3OS MolecularWeight: 359.87302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2C)SCC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2C)SCC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C18H18ClN3OS/c1-12-6-4-5-7-15(12)17-20-21-18(22(17)2)24-11-13-10-14(19)8-9-16(13)23-3/h4-10H,11H2,1-3H3