3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-[(2-phenylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-[(2-phenylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-[(2-phenylphenoxy)methyl]-1,2,4-triazole CAS Name: 3-[2-(4-ethoxyphenoxy)ethylthio]-5-[(2-phenylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-5-[(2-phenylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[2-(4-ethoxyphenoxy)ethylthio]-5-[(2-phenylphenoxy)methyl]-1,2,4-triazole Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NN=C(N2CC=C)COC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NN=C(N2CC=C)COC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C28H29N3O3S/c1-3-18-31-27(21-34-26-13-9-8-12-25(26)22-10-6-5-7-11-22)29-30-28(31)35-20-19-33-24-16-14-23(15-17-24)32-4-2/h3,5-17H,1,4,18-21H2,2H3