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

Systemtic Name: 3-(4-methylphenyl)-4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-4-phenyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 3-(4-methylphenyl)-4-phenyl-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 3-(4-methylphenyl)-4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-4-phenyl-5-(p-tolyl)-1,2,4-triazole Formula: C18H17N3S MolecularWeight: 307.41268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC=C

InChI

InChI=1S/C18H17N3S/c1-3-13-22-18-20-19-17(15-11-9-14(2)10-12-15)21(18)16-7-5-4-6-8-16/h3-12H,1,13H2,2H3