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

Systemtic Name: 2-[5-phenethyl-6-[(phenylmethyl)sulfonylamino]pyrimidin-4-yl]oxyethyl ethanoate Openeye Name: 2-[6-(benzylsulfonylamino)-5-phenethyl-pyrimidin-4-yl]oxyethyl acetate CAS Name: acetic acid 2-[[5-phenethyl-6-[(phenylmethyl)sulfonylamino]-4-pyrimidinyl]oxy]ethyl ester IUPAC Name: 2-[6-(benzylsulfonylamino)-5-phenethylpyrimidin-4-yl]oxyethyl acetate Traditional Name: acetic acid 2-[6-(benzylsulfonylamino)-5-phenethyl-pyrimidin-4-yl]oxyethyl ester Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCOC1=NC=NC(=C1CCC2=CC=CC=C2)NS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)OCCOC1=NC=NC(=C1CCC2=CC=CC=C2)NS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O5S/c1-18(27)30-14-15-31-23-21(13-12-19-8-4-2-5-9-19)22(24-17-25-23)26-32(28,29)16-20-10-6-3-7-11-20/h2-11,17H,12-16H2,1H3,(H,24,25,26)