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

Systemtic Name: 3-(4-chlorophenyl)-4-ethyl-5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(4-chlorophenyl)-4-ethyl-5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-4-ethyl-5-[(2-methoxy-5-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-4-ethyl-5-[(2-methoxy-5-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(4-chlorophenyl)-4-ethyl-5-[(2-methoxy-5-methyl-benzyl)thio]-1,2,4-triazole Formula: C19H20ClN3OS MolecularWeight: 373.8996

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=C(C=CC(=C2)C)OC)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1SCC2=C(C=CC(=C2)C)OC)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN3OS/c1-4-23-18(14-6-8-16(20)9-7-14)21-22-19(23)25-12-15-11-13(2)5-10-17(15)24-3/h5-11H,4,12H2,1-3H3