5-(2-chlorophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(2-chlorophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate Openeye Name: 4-allyl-5-(2-chlorophenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(2-chlorophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-(2-chlorophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate Traditional Name: 4-allyl-5-(2-chlorophenyl)-1,2,4-triazole-3-thiolate Formula: C11H9ClN3S- MolecularWeight: 250.72726

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1[S-])C2=CC=CC=C2Cl

Isomeric SMILES

C=CCN1C(=NN=C1[S-])C2=CC=CC=C2Cl

InChI

InChI=1S/C11H10ClN3S/c1-2-7-15-10(13-14-11(15)16)8-5-3-4-6-9(8)12/h2-6H,1,7H2,(H,14,16)/p-1