3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole CAS Name: 3-[2-(4-ethoxyphenoxy)ethylthio]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole IUPAC Name: 3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-[2-(4-ethoxyphenoxy)ethylthio]-5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazole Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4OC

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H25N3O3S/c1-3-30-20-13-15-21(16-14-20)31-17-18-32-25-27-26-24(22-11-7-8-12-23(22)29-2)28(25)19-9-5-4-6-10-19/h4-16H,3,17-18H2,1-2H3