4-(4-phenylmethoxyphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(4-phenylmethoxyphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 3-allylsulfanyl-4-(4-benzyloxyphenyl)-1H-1,2,4-triazol-5-one CAS Name: 4-(4-phenylmethoxyphenyl)-3-(prop-2-enylthio)-1H-1,2,4-triazol-5-one IUPAC Name: 4-(4-phenylmethoxyphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 3-(allylthio)-4-(4-benzoxyphenyl)-1H-1,2,4-triazol-5-one Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NNC(=O)N1C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C=CCSC1=NNC(=O)N1C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S/c1-2-12-24-18-20-19-17(22)21(18)15-8-10-16(11-9-15)23-13-14-6-4-3-5-7-14/h2-11H,1,12-13H2,(H,19,22)