[4-[2-(3-tert-butylphenoxy)ethanoylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-[2-(3-tert-butylphenoxy)ethanoylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-[[2-(3-tert-butylphenoxy)acetyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[2-(3-tert-butylphenoxy)-1-oxoethyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-[[2-(3-tert-butylphenoxy)acetyl]amino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-[[2-(3-tert-butylphenoxy)acetyl]amino]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C22H23N4O4S- MolecularWeight: 439.50742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4S/c1-22(2,3)16-6-4-7-18(14-16)30-15-20(27)25-17-8-10-19(11-9-17)31(28,29)26-21-23-12-5-13-24-21/h4-14H,15H2,1-3H3,(H2,23,24,25,26,27)/p-1