4-[(Z)-(4-nitrophenyl)methylideneamino]-5-propyl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(Z)-(4-nitrophenyl)methylideneamino]-5-propyl-1,2,4-triazole-3-thiolate Openeye Name: 4-[(Z)-(4-nitrophenyl)methyleneamino]-5-propyl-1,2,4-triazole-3-thiolate CAS Name: 4-[(Z)-(4-nitrophenyl)methylideneamino]-5-propyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(Z)-(4-nitrophenyl)methylideneamino]-5-propyl-1,2,4-triazole-3-thiolate Traditional Name: 4-[(Z)-(4-nitrobenzylidene)amino]-5-propyl-1,2,4-triazole-3-thiolate Formula: C12H12N5O2S- MolecularWeight: 290.32098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1N=CC2=CC=C(C=C2)[N+](=O)[O-])[S-]

Isomeric SMILES

CCCC1=NN=C(N1/N=C\C2=CC=C(C=C2)[N+](=O)[O-])[S-]

InChI

InChI=1S/C12H13N5O2S/c1-2-3-11-14-15-12(20)16(11)13-8-9-4-6-10(7-5-9)17(18)19/h4-8H,2-3H2,1H3,(H,15,20)/p-1/b13-8-