3-methoxy-N-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide

Systemtic Name: 3-methoxy-N-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide Openeye Name: 3-methoxy-N-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide CAS Name: 3-methoxy-N-[4-[[2-methyl-6-(1-pyrazolyl)-4-pyrimidinyl]amino]phenyl]benzenesulfonamide IUPAC Name: 3-methoxy-N-[4-[(2-methyl-6-pyrazol-1-ylpyrimidin-4-yl)amino]phenyl]benzenesulfonamide Traditional Name: 3-methoxy-N-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide Formula: C21H20N6O3S MolecularWeight: 436.4869

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)OC)N4C=CC=N4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)OC)N4C=CC=N4

InChI

InChI=1S/C21H20N6O3S/c1-15-23-20(14-21(24-15)27-12-4-11-22-27)25-16-7-9-17(10-8-16)26-31(28,29)19-6-3-5-18(13-19)30-2/h3-14,26H,1-2H3,(H,23,24,25)