3-(4-chlorophenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(4-chlorophenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-(4-chlorophenyl)-5-(2-methylallylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-(4-chlorophenyl)-5-(2-methylprop-2-enylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-(4-chlorophenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-(4-chlorophenyl)-5-(2-methylallylthio)-1,2,4-triazol-4-yl]amine Formula: C12H13ClN4S MolecularWeight: 280.77642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NN=C(N1N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=C)CSC1=NN=C(N1N)C2=CC=C(C=C2)Cl

InChI

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