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

Systemtic Name: 3-(4-methylphenyl)-5-(3-phenylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-cinnamylsulfanyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 3-(4-methylphenyl)-5-(3-phenylprop-2-enylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-(4-methylphenyl)-5-(3-phenylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(cinnamylthio)-5-(p-tolyl)-1,2,4-triazole Formula: C21H21N3S MolecularWeight: 347.47654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC=CC3=CC=CC=C3

InChI

InChI=1S/C21H21N3S/c1-3-15-24-20(19-13-11-17(2)12-14-19)22-23-21(24)25-16-7-10-18-8-5-4-6-9-18/h3-14H,1,15-16H2,2H3