3-[2-(4-methoxyphenoxy)ethylsulfanyl]-4-(phenylmethyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-(4-methoxyphenoxy)ethylsulfanyl]-4-(phenylmethyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-benzyl-3-[2-(4-methoxyphenoxy)ethylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 3-[2-(4-methoxyphenoxy)ethylthio]-4-(phenylmethyl)-1H-1,2,4-triazol-5-one IUPAC Name: 4-benzyl-3-[2-(4-methoxyphenoxy)ethylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-benzyl-3-[2-(4-methoxyphenoxy)ethylthio]-1H-1,2,4-triazol-5-one Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCSC2=NNC(=O)N2CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)OCCSC2=NNC(=O)N2CC3=CC=CC=C3

InChI

InChI=1S/C18H19N3O3S/c1-23-15-7-9-16(10-8-15)24-11-12-25-18-20-19-17(22)21(18)13-14-5-3-2-4-6-14/h2-10H,11-13H2,1H3,(H,19,22)