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

Systemtic Name: N-[7-nitro-2,4-bis(oxidanylidene)-6-(3-oxidanylpyrrolidin-1-yl)-1H-quinazolin-3-yl]methanesulfonamide Openeye Name: N-[6-(3-hydroxypyrrolidin-1-yl)-7-nitro-2,4-dioxo-1H-quinazolin-3-yl]methanesulfonamide CAS Name: N-[6-(3-hydroxy-1-pyrrolidinyl)-7-nitro-2,4-dioxo-1H-quinazolin-3-yl]methanesulfonamide IUPAC Name: N-[6-(3-hydroxypyrrolidin-1-yl)-7-nitro-2,4-dioxo-1H-quinazolin-3-yl]methanesulfonamide Traditional Name: N-[6-(3-hydroxypyrrolidino)-2,4-diketo-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-])N3CCC(C3)O

Isomeric SMILES

CS(=O)(=O)NN1C(=O)C2=CC(=C(C=C2NC1=O)[N+](=O)[O-])N3CCC(C3)O

InChI

InChI=1S/C13H15N5O7S/c1-26(24,25)15-17-12(20)8-4-10(16-3-2-7(19)6-16)11(18(22)23)5-9(8)14-13(17)21/h4-5,7,15,19H,2-3,6H2,1H3,(H,14,21)