2-[5-methanoyl-6-[(phenylmethyl)sulfonylamino]pyrimidin-4-yl]oxyethyl ethanoate

Systemtic Name: 2-[5-methanoyl-6-[(phenylmethyl)sulfonylamino]pyrimidin-4-yl]oxyethyl ethanoate Openeye Name: 2-[6-(benzylsulfonylamino)-5-formyl-pyrimidin-4-yl]oxyethyl acetate CAS Name: acetic acid 2-[[5-formyl-6-[(phenylmethyl)sulfonylamino]-4-pyrimidinyl]oxy]ethyl ester IUPAC Name: 2-[6-(benzylsulfonylamino)-5-formylpyrimidin-4-yl]oxyethyl acetate Traditional Name: acetic acid 2-[6-(benzylsulfonylamino)-5-formyl-pyrimidin-4-yl]oxyethyl ester Formula: C16H17N3O6S MolecularWeight: 379.38768

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCOC1=NC=NC(=C1C=O)NS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(=O)OCCOC1=NC=NC(=C1C=O)NS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C16H17N3O6S/c1-12(21)24-7-8-25-16-14(9-20)15(17-11-18-16)19-26(22,23)10-13-5-3-2-4-6-13/h2-6,9,11H,7-8,10H2,1H3,(H,17,18,19)