4-methyl-3-(4-methylphenyl)-5-phenethylsulfanyl-1,2,4-triazole

Systemtic Name: 4-methyl-3-(4-methylphenyl)-5-phenethylsulfanyl-1,2,4-triazole Openeye Name: 4-methyl-3-phenethylsulfanyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 4-methyl-3-(4-methylphenyl)-5-(phenethylthio)-1,2,4-triazole IUPAC Name: 4-methyl-3-(4-methylphenyl)-5-phenethylsulfanyl-1,2,4-triazole Traditional Name: 4-methyl-3-(phenethylthio)-5-(p-tolyl)-1,2,4-triazole Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)SCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)SCCC3=CC=CC=C3

InChI

InChI=1S/C18H19N3S/c1-14-8-10-16(11-9-14)17-19-20-18(21(17)2)22-13-12-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3