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

Systemtic Name: 3-[(2,4-dimethylphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(2,4-dimethylphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-[(2,4-dimethylphenoxy)methyl]-5-(2-phenoxyethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-[(2,4-dimethylphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(2,4-dimethylphenoxy)methyl]-5-(2-phenoxyethylthio)-1,2,4-triazol-4-yl]amine Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NN=C(N2N)SCCOC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NN=C(N2N)SCCOC3=CC=CC=C3)C

InChI

InChI=1S/C19H22N4O2S/c1-14-8-9-17(15(2)12-14)25-13-18-21-22-19(23(18)20)26-11-10-24-16-6-4-3-5-7-16/h3-9,12H,10-11,13,20H2,1-2H3