3-(2-nitrophenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(2-nitrophenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(2-nitrobenzoyl)-2-thioxo-quinazolin-4-olate CAS Name: 3-[(2-nitrophenyl)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(2-nitrobenzoyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(2-nitrobenzoyl)-2-thioxo-quinazolin-4-olate Formula: C15H8N3O4S- MolecularWeight: 326.30672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N2C(=C3C=CC=CC3=NC2=S)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N2C(=C3C=CC=CC3=NC2=S)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9N3O4S/c19-13-9-5-1-3-7-11(9)16-15(23)17(13)14(20)10-6-2-4-8-12(10)18(21)22/h1-8,19H/p-1