[3-acetyloxy-2-[5-bromanyl-2-[(4-sulfamoylphenyl)amino]pyrimidin-4-yl]oxy-propyl] ethanoate

Systemtic Name: [3-acetyloxy-2-[5-bromanyl-2-[(4-sulfamoylphenyl)amino]pyrimidin-4-yl]oxy-propyl] ethanoate Openeye Name: [3-acetoxy-2-[5-bromo-2-(4-sulfamoylanilino)pyrimidin-4-yl]oxy-propyl] acetate CAS Name: acetic acid [3-acetyloxy-2-[[5-bromo-2-(4-sulfamoylanilino)-4-pyrimidinyl]oxy]propyl] ester IUPAC Name: [3-acetyloxy-2-[5-bromo-2-(4-sulfamoylanilino)pyrimidin-4-yl]oxypropyl] acetate Traditional Name: acetic acid [3-acetoxy-2-[5-bromo-2-(4-sulfamoylanilino)pyrimidin-4-yl]oxy-propyl] ester Formula: C17H19BrN4O7S MolecularWeight: 503.32436

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(COC(=O)C)OC1=NC(=NC=C1Br)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC(=O)OCC(COC(=O)C)OC1=NC(=NC=C1Br)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H19BrN4O7S/c1-10(23)27-8-13(9-28-11(2)24)29-16-15(18)7-20-17(22-16)21-12-3-5-14(6-4-12)30(19,25)26/h3-7,13H,8-9H2,1-2H3,(H2,19,25,26)(H,20,21,22)