N-[(4-nitrophenyl)amino]-4-sulfanylidene-cyclohexa-2,5-dien-1-imine oxide

Systemtic Name: N-[(4-nitrophenyl)amino]-4-sulfanylidene-cyclohexa-2,5-dien-1-imine oxide Openeye Name: N-(4-nitroanilino)-4-thioxo-cyclohexa-2,5-dien-1-imine oxide CAS Name: N-(4-nitroanilino)-4-sulfanylidene-1-cyclohexa-2,5-dienimine oxide IUPAC Name: N-(4-nitroanilino)-4-sulfanylidenecyclohexa-2,5-dien-1-imine oxide Traditional Name: N-(4-nitroanilino)-4-thioxo-cyclohexa-2,5-dien-1-imine oxide Formula: C12H9N3O3S MolecularWeight: 275.28316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=S)C=CC1=[N+](NC2=CC=C(C=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC(=S)C=CC1=[N+](NC2=CC=C(C=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C12H9N3O3S/c16-14(10-5-7-12(19)8-6-10)13-9-1-3-11(4-2-9)15(17)18/h1-8,13H