3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]oxy-N-phenethyl-propanamide

Systemtic Name: 3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]oxy-N-phenethyl-propanamide Openeye Name: 3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]oxy-N-phenethyl-propanamide CAS Name: 3-[[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-(2-pyrimidinyl)-4-pyrimidinyl]oxy]-N-phenethylpropanamide IUPAC Name: 3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]oxy-N-phenethylpropanamide Traditional Name: 3-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-(2-pyrimidyl)pyrimidin-4-yl]oxy-N-phenethyl-propionamide Formula: C36H38N6O6S MolecularWeight: 682.78852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCC(=O)NCCC4=CC=CC=C4)OC5=CC=CC=C5OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCC(=O)NCCC4=CC=CC=C4)OC5=CC=CC=C5OC

InChI

InChI=1S/C36H38N6O6S/c1-36(2,3)26-15-17-27(18-16-26)49(44,45)42-32-31(48-29-14-9-8-13-28(29)46-4)35(41-34(40-32)33-38-21-10-22-39-33)47-24-20-30(43)37-23-19-25-11-6-5-7-12-25/h5-18,21-22H,19-20,23-24H2,1-4H3,(H,37,43)(H,40,41,42)