4-[(4-azanyl-6-ethoxy-5-nitroso-pyrimidin-2-yl)amino]benzenesulfonamide

Systemtic Name: 4-[(4-azanyl-6-ethoxy-5-nitroso-pyrimidin-2-yl)amino]benzenesulfonamide Openeye Name: 4-[(4-amino-6-ethoxy-5-nitroso-pyrimidin-2-yl)amino]benzenesulfonamide CAS Name: 4-[(4-amino-6-ethoxy-5-nitroso-2-pyrimidinyl)amino]benzenesulfonamide IUPAC Name: 4-[(4-amino-6-ethoxy-5-nitrosopyrimidin-2-yl)amino]benzenesulfonamide Traditional Name: 4-[(4-amino-6-ethoxy-5-nitroso-pyrimidin-2-yl)amino]benzenesulfonamide Formula: C12H14N6O4S MolecularWeight: 338.34236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=C1N=O)N)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCOC1=NC(=NC(=C1N=O)N)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C12H14N6O4S/c1-2-22-11-9(18-19)10(13)16-12(17-11)15-7-3-5-8(6-4-7)23(14,20)21/h3-6H,2H2,1H3,(H2,14,20,21)(H3,13,15,16,17)