[2-(5-nitrothiophen-3-yl)-4-oxidanylidene-1H-quinazolin-6-yl] ethanoate

Systemtic Name: [2-(5-nitrothiophen-3-yl)-4-oxidanylidene-1H-quinazolin-6-yl] ethanoate Openeye Name: [2-(5-nitro-3-thienyl)-4-oxo-1H-quinazolin-6-yl] acetate CAS Name: acetic acid [2-(5-nitro-3-thiophenyl)-4-oxo-1H-quinazolin-6-yl] ester IUPAC Name: [2-(5-nitrothiophen-3-yl)-4-oxo-1H-quinazolin-6-yl] acetate Traditional Name: acetic acid [4-keto-2-(5-nitro-3-thienyl)-1H-quinazolin-6-yl] ester Formula: C14H9N3O5S MolecularWeight: 331.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)NC(=NC2=O)C3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)NC(=NC2=O)C3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O5S/c1-7(18)22-9-2-3-11-10(5-9)14(19)16-13(15-11)8-4-12(17(20)21)23-6-8/h2-6H,1H3,(H,15,16,19)