4-cyclopropyl-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-cyclopropyl-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-cyclopropyl-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-cyclopropyl-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-cyclopropyl-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-cyclopropyl-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate Formula: C11H9N4O2S- MolecularWeight: 261.27976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2[S-])C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1N2C(=NN=C2[S-])C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C11H10N4O2S/c16-15(17)9-3-1-7(2-4-9)10-12-13-11(18)14(10)8-5-6-8/h1-4,8H,5-6H2,(H,13,18)/p-1