5-[[5-bromanyl-4-[[(2R)-1-oxidanylbutan-2-yl]amino]pyrimidin-2-yl]amino]pyridine-2-sulfonamide

Systemtic Name: 5-[[5-bromanyl-4-[[(2R)-1-oxidanylbutan-2-yl]amino]pyrimidin-2-yl]amino]pyridine-2-sulfonamide Openeye Name: 5-[[5-bromo-4-[[(1R)-1-(hydroxymethyl)propyl]amino]pyrimidin-2-yl]amino]pyridine-2-sulfonamide CAS Name: 5-[[5-bromo-4-[[(2R)-1-hydroxybutan-2-yl]amino]-2-pyrimidinyl]amino]-2-pyridinesulfonamide IUPAC Name: 5-[[5-bromo-4-[[(2R)-1-hydroxybutan-2-yl]amino]pyrimidin-2-yl]amino]pyridine-2-sulfonamide Traditional Name: 5-[[5-bromo-4-[[(1R)-1-methylolpropyl]amino]pyrimidin-2-yl]amino]pyridine-2-sulfonamide Formula: C13H17BrN6O3S MolecularWeight: 417.28148

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC(=NC=C1Br)NC2=CN=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC[C@H](CO)NC1=NC(=NC=C1Br)NC2=CN=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C13H17BrN6O3S/c1-2-8(7-21)18-12-10(14)6-17-13(20-12)19-9-3-4-11(16-5-9)24(15,22)23/h3-6,8,21H,2,7H2,1H3,(H2,15,22,23)(H2,17,18,19,20)/t8-/m1/s1