3-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-(2,6-dimethylphenoxy)ethylthio]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[2-(2,6-dimethylphenoxy)ethylthio]-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]amine Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCSC2=NN=C(N2N)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCSC2=NN=C(N2N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H22N4O2S/c1-13-5-4-6-14(2)17(13)25-11-12-26-19-22-21-18(23(19)20)15-7-9-16(24-3)10-8-15/h4-10H,11-12,20H2,1-3H3