N-[4-[[(6-nitro-4-oxidanylidene-1H-quinazolin-7-yl)amino]methyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[[(6-nitro-4-oxidanylidene-1H-quinazolin-7-yl)amino]methyl]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[(6-nitro-4-oxo-1H-quinazolin-7-yl)amino]methyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[[(6-nitro-4-oxo-1H-quinazolin-7-yl)amino]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[(6-nitro-4-oxo-1H-quinazolin-7-yl)amino]methyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[(4-keto-6-nitro-1H-quinazolin-7-yl)amino]methyl]phenyl]-2-furamide Formula: C20H15N5O5 MolecularWeight: 405.3636

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)CNC3=C(C=C4C(=C3)NC=NC4=O)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)CNC3=C(C=C4C(=C3)NC=NC4=O)[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O5/c26-19-14-8-17(25(28)29)16(9-15(14)22-11-23-19)21-10-12-3-5-13(6-4-12)24-20(27)18-2-1-7-30-18/h1-9,11,21H,10H2,(H,24,27)(H,22,23,26)