3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]oxy-2-methyl-propanoic acid

Systemtic Name: 3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]oxy-2-methyl-propanoic acid Openeye Name: 3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]oxy-2-methyl-propanoic acid CAS Name: 3-[[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-(2-pyrimidinyl)-4-pyrimidinyl]oxy]-2-methylpropanoic acid IUPAC Name: 3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]oxy-2-methylpropanoic acid Traditional Name: 3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-(2-pyrimidyl)pyrimidin-4-yl]oxy-2-methyl-propionic acid Formula: C29H31N5O7S MolecularWeight: 593.65074

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=NC(=NC(=C1OC2=CC=CC=C2OC)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C4=NC=CC=N4)C(=O)O

Isomeric SMILES

CC(COC1=NC(=NC(=C1OC2=CC=CC=C2OC)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C4=NC=CC=N4)C(=O)O

InChI

InChI=1S/C29H31N5O7S/c1-18(28(35)36)17-40-27-23(41-22-10-7-6-9-21(22)39-5)24(32-26(33-27)25-30-15-8-16-31-25)34-42(37,38)20-13-11-19(12-14-20)29(2,3)4/h6-16,18H,17H2,1-5H3,(H,35,36)(H,32,33,34)