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

Systemtic Name: 3-[(3-methoxyphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(3-methoxyphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-[(3-methoxyphenoxy)methyl]-5-(2-phenoxyethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-methoxyphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(3-methoxyphenoxy)methyl]-5-(2-phenoxyethylthio)-1,2,4-triazol-4-yl]amine Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCC2=NN=C(N2N)SCCOC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC=C1)OCC2=NN=C(N2N)SCCOC3=CC=CC=C3

InChI

InChI=1S/C18H20N4O3S/c1-23-15-8-5-9-16(12-15)25-13-17-20-21-18(22(17)19)26-11-10-24-14-6-3-2-4-7-14/h2-9,12H,10-11,13,19H2,1H3