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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N5O2S/c1-2-4-11-14-15-12(20)16(11)13-8-9-5-3-6-10(7-9)17(18)19/h3,5-8H,2,4H2,1H3,(H,15,20)/p-1/b13-8-