4-[5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline

Systemtic Name: 4-[5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline Openeye Name: 4-[5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline CAS Name: 4-[5-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-4-ethyl-1,2,4-triazol-3-yl]aniline IUPAC Name: 4-[5-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline Traditional Name: [4-[5-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-4-ethyl-1,2,4-triazol-3-yl]phenyl]amine Formula: C23H30N4S MolecularWeight: 394.5761

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=C(C=C(C=C2C)C(C)(C)C)C)C3=CC=C(C=C3)N

Isomeric SMILES

CCN1C(=NN=C1SCC2=C(C=C(C=C2C)C(C)(C)C)C)C3=CC=C(C=C3)N

InChI

InChI=1S/C23H30N4S/c1-7-27-21(17-8-10-19(24)11-9-17)25-26-22(27)28-14-20-15(2)12-18(13-16(20)3)23(4,5)6/h8-13H,7,14,24H2,1-6H3