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

Systemtic Name: 3-chloranyl-N-[4-[(6-imidazol-1-yl-2-methyl-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide Openeye Name: 3-chloro-N-[4-[(6-imidazol-1-yl-2-methyl-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide CAS Name: 3-chloro-N-[4-[[6-(1-imidazolyl)-2-methyl-4-pyrimidinyl]amino]phenyl]benzenesulfonamide IUPAC Name: 3-chloro-N-[4-[(6-imidazol-1-yl-2-methylpyrimidin-4-yl)amino]phenyl]benzenesulfonamide Traditional Name: 3-chloro-N-[4-[(6-imidazol-1-yl-2-methyl-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide Formula: C20H17ClN6O2S MolecularWeight: 440.90598

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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)Cl)N4C=CN=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC(=CC=C3)Cl)N4C=CN=C4

InChI

InChI=1S/C20H17ClN6O2S/c1-14-23-19(12-20(24-14)27-10-9-22-13-27)25-16-5-7-17(8-6-16)26-30(28,29)18-4-2-3-15(21)11-18/h2-13,26H,1H3,(H,23,24,25)