N-[3-[(5-nitrofuran-2-yl)carbonylamino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[(5-nitrofuran-2-yl)carbonylamino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[(5-nitrofuran-2-carbonyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[(5-nitro-2-furanyl)-oxomethyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[(5-nitrofuran-2-carbonyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: 4-keto-N-[3-[(5-nitro-2-furoyl)amino]propyl]-1H-quinazoline-2-carboxamide Formula: C17H15N5O6 MolecularWeight: 385.3309

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=O)NCCCNC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=O)NCCCNC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O6/c23-15-10-4-1-2-5-11(10)20-14(21-15)17(25)19-9-3-8-18-16(24)12-6-7-13(28-12)22(26)27/h1-2,4-7H,3,8-9H2,(H,18,24)(H,19,25)(H,20,21,23)