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

Systemtic Name: N,N-diethyl-4-[[5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-yl]amino]benzenesulfonamide Openeye Name: N,N-diethyl-4-[[5-nitro-6-(2-phenylhydrazino)pyrimidin-4-yl]amino]benzenesulfonamide CAS Name: N,N-diethyl-4-[[5-nitro-6-(phenylhydrazo)-4-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[[5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-yl]amino]benzenesulfonamide Traditional Name: N,N-diethyl-4-[[5-nitro-6-(N'-phenylhydrazino)pyrimidin-4-yl]amino]benzenesulfonamide Formula: C20H23N7O4S MolecularWeight: 457.50612

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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)NNC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N7O4S/c1-3-26(4-2)32(30,31)17-12-10-15(11-13-17)23-19-18(27(28)29)20(22-14-21-19)25-24-16-8-6-5-7-9-16/h5-14,24H,3-4H2,1-2H3,(H2,21,22,23,25)