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

Systemtic Name: 4-(2-methylphenyl)-3-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-4-(o-tolyl)-1,2,4-triazole CAS Name: 4-(2-methylphenyl)-3-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 4-(2-methylphenyl)-3-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-4-(o-tolyl)-1,2,4-triazole Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCC=C

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCC=C

InChI

InChI=1S/C12H13N3S/c1-3-8-16-12-14-13-9-15(12)11-7-5-4-6-10(11)2/h3-7,9H,1,8H2,2H3