3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4,5-dimethoxy-2-methylphenyl)methylthio]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4,5-dimethoxy-2-methyl-benzyl)thio]-5-p-anisyl-1,2,4-triazol-4-yl]amine Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSC2=NN=C(N2N)CC3=CC=C(C=C3)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CSC2=NN=C(N2N)CC3=CC=C(C=C3)OC)OC)OC

InChI

InChI=1S/C20H24N4O3S/c1-13-9-17(26-3)18(27-4)11-15(13)12-28-20-23-22-19(24(20)21)10-14-5-7-16(25-2)8-6-14/h5-9,11H,10,12,21H2,1-4H3