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

Systemtic Name: 5-(3-bromophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate Openeye Name: 4-allyl-5-(3-bromophenyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(3-bromophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-(3-bromophenyl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate Traditional Name: 4-allyl-5-(3-bromophenyl)-1,2,4-triazole-3-thiolate Formula: C11H9BrN3S- MolecularWeight: 295.17826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10BrN3S/c1-2-6-15-10(13-14-11(15)16)8-4-3-5-9(12)7-8/h2-5,7H,1,6H2,(H,14,16)/p-1