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

Systemtic Name: 4-[(6-diazanyl-5-nitro-pyrimidin-4-yl)amino]-N,N-diethyl-benzenesulfonamide Openeye Name: N,N-diethyl-4-[(6-hydrazino-5-nitro-pyrimidin-4-yl)amino]benzenesulfonamide CAS Name: N,N-diethyl-4-[(6-hydrazinyl-5-nitro-4-pyrimidinyl)amino]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[(6-hydrazinyl-5-nitropyrimidin-4-yl)amino]benzenesulfonamide Traditional Name: N,N-diethyl-4-[(6-hydrazino-5-nitro-pyrimidin-4-yl)amino]benzenesulfonamide Formula: C14H19N7O4S MolecularWeight: 381.41016

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N7O4S/c1-3-20(4-2)26(24,25)11-7-5-10(6-8-11)18-13-12(21(22)23)14(19-15)17-9-16-13/h5-9H,3-4,15H2,1-2H3,(H2,16,17,18,19)