N-[6-morpholin-4-yl-7-nitro-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]methanesulfonamide

Systemtic Name: N-[6-morpholin-4-yl-7-nitro-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]methanesulfonamide Openeye Name: N-(6-morpholino-7-nitro-2,4-dioxo-1H-quinazolin-3-yl)methanesulfonamide CAS Name: N-[6-(4-morpholinyl)-7-nitro-2,4-dioxo-1H-quinazolin-3-yl]methanesulfonamide IUPAC Name: N-(6-morpholin-4-yl-7-nitro-2,4-dioxo-1H-quinazolin-3-yl)methanesulfonamide Traditional Name: N-(2,4-diketo-6-morpholino-7-nitro-1H-quinazolin-3-yl)methanesulfonamide Formula: C13H15N5O7S MolecularWeight: 385.3525

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NN1C(=O)C2=CC(=C(C=C2NC1=O)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CS(=O)(=O)NN1C(=O)C2=CC(=C(C=C2NC1=O)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C13H15N5O7S/c1-26(23,24)15-17-12(19)8-6-10(16-2-4-25-5-3-16)11(18(21)22)7-9(8)14-13(17)20/h6-7,15H,2-5H2,1H3,(H,14,20)