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

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-[(4,5-dimethoxy-2-methylphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-3-[(4,5-dimethoxy-2-methyl-benzyl)thio]-1H-1,2,4-triazole Formula: C19H20ClN3O3S MolecularWeight: 405.8984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSC2=NNC(=N2)C3=C(C=CC(=C3)Cl)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CSC2=NNC(=N2)C3=C(C=CC(=C3)Cl)OC)OC)OC

InChI

InChI=1S/C19H20ClN3O3S/c1-11-7-16(25-3)17(26-4)8-12(11)10-27-19-21-18(22-23-19)14-9-13(20)5-6-15(14)24-2/h5-9H,10H2,1-4H3,(H,21,22,23)