ethyl 4-[(2-azanylpyrimidin-5-yl)sulfonylamino]benzoate

Systemtic Name: ethyl 4-[(2-azanylpyrimidin-5-yl)sulfonylamino]benzoate Openeye Name: ethyl 4-[(2-aminopyrimidin-5-yl)sulfonylamino]benzoate CAS Name: 4-[(2-amino-5-pyrimidinyl)sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-aminopyrimidin-5-yl)sulfonylamino]benzoate Traditional Name: 4-[(2-aminopyrimidin-5-yl)sulfonylamino]benzoic acid ethyl ester Formula: C13H14N4O4S MolecularWeight: 322.33966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN=C(N=C2)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN=C(N=C2)N

InChI

InChI=1S/C13H14N4O4S/c1-2-21-12(18)9-3-5-10(6-4-9)17-22(19,20)11-7-15-13(14)16-8-11/h3-8,17H,2H2,1H3,(H2,14,15,16)