3-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(2-isopropyl-5-methyl-phenoxy)methyl]-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(5-methyl-2-propan-2-ylphenoxy)methyl]-5-[[4-(methylthio)phenyl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(5-methyl-2-propan-2-ylphenoxy)methyl]-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(2-isopropyl-5-methyl-phenoxy)methyl]-5-[[4-(methylthio)benzyl]thio]-1,2,4-triazol-4-yl]amine Formula: C21H26N4OS2 MolecularWeight: 414.58734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=NN=C(N2N)SCC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=NN=C(N2N)SCC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H26N4OS2/c1-14(2)18-10-5-15(3)11-19(18)26-12-20-23-24-21(25(20)22)28-13-16-6-8-17(27-4)9-7-16/h5-11,14H,12-13,22H2,1-4H3