2-(5-nitrothiophen-3-yl)-6-oxidanyl-1H-quinazolin-4-one

Systemtic Name: 2-(5-nitrothiophen-3-yl)-6-oxidanyl-1H-quinazolin-4-one Openeye Name: 6-hydroxy-2-(5-nitro-3-thienyl)-1H-quinazolin-4-one CAS Name: 6-hydroxy-2-(5-nitro-3-thiophenyl)-1H-quinazolin-4-one IUPAC Name: 6-hydroxy-2-(5-nitrothiophen-3-yl)-1H-quinazolin-4-one Traditional Name: 6-hydroxy-2-(5-nitro-3-thienyl)-1H-quinazolin-4-one Formula: C12H7N3O4S MolecularWeight: 289.26668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=O)N=C(N2)C3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1O)C(=O)N=C(N2)C3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H7N3O4S/c16-7-1-2-9-8(4-7)12(17)14-11(13-9)6-3-10(15(18)19)20-5-6/h1-5,16H,(H,13,14,17)