4-(4-methylphenyl)-3-(phenoxymethyl)-5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-(4-methylphenyl)-3-(phenoxymethyl)-5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazole Openeye Name: 3-cinnamylsulfanyl-5-(phenoxymethyl)-4-(p-tolyl)-1,2,4-triazole CAS Name: 4-(4-methylphenyl)-3-(phenoxymethyl)-5-(3-phenylprop-2-enylthio)-1,2,4-triazole IUPAC Name: 4-(4-methylphenyl)-3-(phenoxymethyl)-5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazole Traditional Name: 3-(cinnamylthio)-5-(phenoxymethyl)-4-(p-tolyl)-1,2,4-triazole Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC=CC3=CC=CC=C3)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC=CC3=CC=CC=C3)COC4=CC=CC=C4

InChI

InChI=1S/C25H23N3OS/c1-20-14-16-22(17-15-20)28-24(19-29-23-12-6-3-7-13-23)26-27-25(28)30-18-8-11-21-9-4-2-5-10-21/h2-17H,18-19H2,1H3