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

Systemtic Name: N,N-diethyl-4-[[5-nitro-6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]benzenesulfonamide Openeye Name: N,N-diethyl-4-[[5-nitro-6-(2-pyridylamino)pyrimidin-4-yl]amino]benzenesulfonamide CAS Name: N,N-diethyl-4-[[5-nitro-6-(2-pyridinylamino)-4-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[[5-nitro-6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]benzenesulfonamide Traditional Name: N,N-diethyl-4-[[5-nitro-6-(2-pyridylamino)pyrimidin-4-yl]amino]benzenesulfonamide Formula: C19H21N7O4S MolecularWeight: 443.47954

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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)NC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N7O4S/c1-3-25(4-2)31(29,30)15-10-8-14(9-11-15)23-18-17(26(27)28)19(22-13-21-18)24-16-7-5-6-12-20-16/h5-13H,3-4H2,1-2H3,(H2,20,21,22,23,24)