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

Systemtic Name: N,N-diethyl-4-[[6-(2-methoxyethylamino)-5-nitro-pyrimidin-4-yl]amino]benzenesulfonamide Openeye Name: N,N-diethyl-4-[[6-(2-methoxyethylamino)-5-nitro-pyrimidin-4-yl]amino]benzenesulfonamide CAS Name: N,N-diethyl-4-[[6-(2-methoxyethylamino)-5-nitro-4-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[[6-(2-methoxyethylamino)-5-nitropyrimidin-4-yl]amino]benzenesulfonamide Traditional Name: N,N-diethyl-4-[[6-(2-methoxyethylamino)-5-nitro-pyrimidin-4-yl]amino]benzenesulfonamide Formula: C17H24N6O5S MolecularWeight: 424.47466

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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)NCCOC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H24N6O5S/c1-4-22(5-2)29(26,27)14-8-6-13(7-9-14)21-17-15(23(24)25)16(19-12-20-17)18-10-11-28-3/h6-9,12H,4-5,10-11H2,1-3H3,(H2,18,19,20,21)