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

Systemtic Name: 3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-(3,5-dimethylphenoxy)ethylthio]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[2-(3,5-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=CC(=CC(=C1)OCCSC2=NN=C(N2N)C3=CC=C(C=C3)OC)C

Isomeric SMILES

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

InChI

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