4-[[6-[2-(2-bromophenyl)carbonylhydrazinyl]-5-nitro-pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[[6-[2-(2-bromophenyl)carbonylhydrazinyl]-5-nitro-pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[[6-[2-(2-bromobenzoyl)hydrazino]-5-nitro-pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[6-[[(2-bromophenyl)-oxomethyl]hydrazo]-5-nitro-4-pyrimidinyl]amino]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[[6-[2-(2-bromobenzoyl)hydrazinyl]-5-nitropyrimidin-4-yl]amino]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[[6-[N'-(2-bromobenzoyl)hydrazino]-5-nitro-pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Formula: C21H22BrN7O5S MolecularWeight: 564.41228

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

InChI

InChI=1S/C21H22BrN7O5S/c1-3-28(4-2)35(33,34)15-11-9-14(10-12-15)25-19-18(29(31)32)20(24-13-23-19)26-27-21(30)16-7-5-6-8-17(16)22/h5-13H,3-4H2,1-2H3,(H,27,30)(H2,23,24,25,26)