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

Systemtic Name: N-[7-nitro-2,4-bis(oxidanylidene)-6-(4-phenylpiperazin-1-yl)-1H-quinazolin-3-yl]methanesulfonamide Openeye Name: N-[7-nitro-2,4-dioxo-6-(4-phenylpiperazin-1-yl)-1H-quinazolin-3-yl]methanesulfonamide CAS Name: N-[7-nitro-2,4-dioxo-6-(4-phenyl-1-piperazinyl)-1H-quinazolin-3-yl]methanesulfonamide IUPAC Name: N-[7-nitro-2,4-dioxo-6-(4-phenylpiperazin-1-yl)-1H-quinazolin-3-yl]methanesulfonamide Traditional Name: N-[2,4-diketo-7-nitro-6-(4-phenylpiperazino)-1H-quinazolin-3-yl]methanesulfonamide Formula: C19H20N6O6S MolecularWeight: 460.4637

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NN1C(=O)C2=CC(=C(C=C2NC1=O)[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)NN1C(=O)C2=CC(=C(C=C2NC1=O)[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C19H20N6O6S/c1-32(30,31)21-24-18(26)14-11-16(17(25(28)29)12-15(14)20-19(24)27)23-9-7-22(8-10-23)13-5-3-2-4-6-13/h2-6,11-12,21H,7-10H2,1H3,(H,20,27)