3-[(2-chlorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(2-chlorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(2-chlorophenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2-chlorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-chlorobenzyl)thio]-1,2,4-triazole Formula: C12H12ClN3S MolecularWeight: 265.76178

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NN=C1SCC2=CC=CC=C2Cl

Isomeric SMILES

C=CCN1C=NN=C1SCC2=CC=CC=C2Cl

InChI

InChI=1S/C12H12ClN3S/c1-2-7-16-9-14-15-12(16)17-8-10-5-3-4-6-11(10)13/h2-6,9H,1,7-8H2