4-(4-methylphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(4-methylphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 3-allylsulfanyl-4-(p-tolyl)-1H-1,2,4-triazol-5-one CAS Name: 4-(4-methylphenyl)-3-(prop-2-enylthio)-1H-1,2,4-triazol-5-one IUPAC Name: 4-(4-methylphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 3-(allylthio)-4-(p-tolyl)-1H-1,2,4-triazol-5-one Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)NN=C2SCC=C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)NN=C2SCC=C

InChI

InChI=1S/C12H13N3OS/c1-3-8-17-12-14-13-11(16)15(12)10-6-4-9(2)5-7-10/h3-7H,1,8H2,2H3,(H,13,16)