pyrimidin-2-yl-[4-[2-(2,3,6-trimethylphenoxy)ethanoylamino]phenyl]sulfonyl-azanide

Systemtic Name: pyrimidin-2-yl-[4-[2-(2,3,6-trimethylphenoxy)ethanoylamino]phenyl]sulfonyl-azanide Openeye Name: pyrimidin-2-yl-[4-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]phenyl]sulfonyl-azanide CAS Name: [4-[[1-oxo-2-(2,3,6-trimethylphenoxy)ethyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: pyrimidin-2-yl-[4-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]phenyl]sulfonylazanide Traditional Name: 2-pyrimidyl-[4-[[2-(2,3,6-trimethylphenoxy)acetyl]amino]phenyl]sulfonyl-azanide Formula: C21H21N4O4S- MolecularWeight: 425.48084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3)C

InChI

InChI=1S/C21H22N4O4S/c1-14-5-6-15(2)20(16(14)3)29-13-19(26)24-17-7-9-18(10-8-17)30(27,28)25-21-22-11-4-12-23-21/h4-12H,13H2,1-3H3,(H2,22,23,24,25,26)/p-1