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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2C)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C)C3=C(C=CC(=C3)Cl)OC

InChI

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