2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)-N-(propan-2-ylcarbamoyl)ethanamide

Systemtic Name: 2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)-N-(propan-2-ylcarbamoyl)ethanamide Openeye Name: N-(isopropylcarbamoyl)-2-(7-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: 2-(7-nitro-4-oxo-3-quinazolinyl)-N-[oxo-(propan-2-ylamino)methyl]acetamide IUPAC Name: 2-(7-nitro-4-oxoquinazolin-3-yl)-N-(propan-2-ylcarbamoyl)acetamide Traditional Name: N-(isopropylcarbamoyl)-2-(4-keto-7-nitro-quinazolin-3-yl)acetamide Formula: C14H15N5O5 MolecularWeight: 333.2994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)CN1C=NC2=C(C1=O)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)NC(=O)CN1C=NC2=C(C1=O)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O5/c1-8(2)16-14(22)17-12(20)6-18-7-15-11-5-9(19(23)24)3-4-10(11)13(18)21/h3-5,7-8H,6H2,1-2H3,(H2,16,17,20,22)