3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-isopropylphenoxy)methyl]-5-[2-(4-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[2-(4-methoxyphenoxy)ethylthio]-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-isopropylphenoxy)methyl]-5-[2-(4-methoxyphenoxy)ethylthio]-1,2,4-triazol-4-yl]amine Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3S/c1-15(2)16-4-6-19(7-5-16)28-14-20-23-24-21(25(20)22)29-13-12-27-18-10-8-17(26-3)9-11-18/h4-11,15H,12-14,22H2,1-3H3