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

Systemtic Name: 4-(4-methylphenyl)-3-(phenylmethyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-benzyl-4-(p-tolyl)-1,2,4-triazole CAS Name: 4-(4-methylphenyl)-3-(phenylmethyl)-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 3-benzyl-4-(4-methylphenyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-5-benzyl-4-(p-tolyl)-1,2,4-triazole Formula: C19H19N3S MolecularWeight: 321.43926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3S/c1-3-13-23-19-21-20-18(14-16-7-5-4-6-8-16)22(19)17-11-9-15(2)10-12-17/h3-12H,1,13-14H2,2H3