3-(2-chloranylprop-2-enylsulfanyl)-5-(4-methylphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(2-chloranylprop-2-enylsulfanyl)-5-(4-methylphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-(2-chloroallylsulfanyl)-5-(p-tolyl)-1,2,4-triazol-4-amine CAS Name: 3-(2-chloroprop-2-enylthio)-5-(4-methylphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-(2-chloroprop-2-enylsulfanyl)-5-(4-methylphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-(2-chloroallylthio)-5-(p-tolyl)-1,2,4-triazol-4-yl]amine Formula: C12H13ClN4S MolecularWeight: 280.77642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=C)Cl

InChI

InChI=1S/C12H13ClN4S/c1-8-3-5-10(6-4-8)11-15-16-12(17(11)14)18-7-9(2)13/h3-6H,2,7,14H2,1H3