3-(cyclohexylmethylsulfanyl)-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(cyclohexylmethylsulfanyl)-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-(cyclohexylmethylsulfanyl)-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-4-amine CAS Name: 3-(cyclohexylmethylthio)-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-(cyclohexylmethylsulfanyl)-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-(cyclohexylmethylthio)-5-[(2,4-dimethylphenoxy)methyl]-1,2,4-triazol-4-yl]amine Formula: C18H26N4OS MolecularWeight: 346.49024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NN=C(N2N)SCC3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NN=C(N2N)SCC3CCCCC3)C

InChI

InChI=1S/C18H26N4OS/c1-13-8-9-16(14(2)10-13)23-11-17-20-21-18(22(17)19)24-12-15-6-4-3-5-7-15/h8-10,15H,3-7,11-12,19H2,1-2H3