N-[4-[[4-[(5-tert-butyl-1,2-oxazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]sulfonylethanamide

Systemtic Name: N-[4-[[4-[(5-tert-butyl-1,2-oxazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]sulfonylethanamide Openeye Name: N-[4-[[4-[(5-tert-butylisoxazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]sulfonylacetamide CAS Name: N-[4-[[4-[(5-tert-butyl-3-isoxazolyl)amino]-2-pyrimidinyl]amino]phenyl]sulfonylacetamide IUPAC Name: N-[4-[[4-[(5-tert-butyl-1,2-oxazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]sulfonylacetamide Traditional Name: N-[4-[[4-[(5-tert-butylisoxazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]sulfonylacetamide Formula: C19H22N6O4S MolecularWeight: 430.48078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC2=NC=CC(=N2)NC3=NOC(=C3)C(C)(C)C

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC2=NC=CC(=N2)NC3=NOC(=C3)C(C)(C)C

InChI

InChI=1S/C19H22N6O4S/c1-12(26)25-30(27,28)14-7-5-13(6-8-14)21-18-20-10-9-16(23-18)22-17-11-15(29-24-17)19(2,3)4/h5-11H,1-4H3,(H,25,26)(H2,20,21,22,23,24)