4-[[5-bromanyl-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[5-bromanyl-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 4-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C16H16BrN7O2S MolecularWeight: 450.31294

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CC1C2=CC(=NN2)NC3=NC(=NC=C3Br)NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C16H16BrN7O2S/c17-12-8-19-16(20-10-3-5-11(6-4-10)27(18,25)26)22-15(12)21-14-7-13(23-24-14)9-1-2-9/h3-9H,1-2H2,(H2,18,25,26)(H3,19,20,21,22,23,24)