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

Systemtic Name: 3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Openeye Name: 3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole CAS Name: 3-[(2-methoxy-5-methylphenyl)methylthio]-5-(4-methoxyphenyl)-1H-1,2,4-triazole IUPAC Name: 3-[(2-methoxy-5-methylphenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Traditional Name: 3-[(2-methoxy-5-methyl-benzyl)thio]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NNC(=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NNC(=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H19N3O2S/c1-12-4-9-16(23-3)14(10-12)11-24-18-19-17(20-21-18)13-5-7-15(22-2)8-6-13/h4-10H,11H2,1-3H3,(H,19,20,21)