methanesulfonic acid; 4-[(2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol

Systemtic Name: methanesulfonic acid; 4-[(2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol Openeye Name: methanesulfonic acid; 4-[(2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexanol CAS Name: methanesulfonic acid; 4-[(2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-1-cyclohexanol IUPAC Name: methanesulfonic acid; 4-[(2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol Traditional Name: mesylic acid; 4-[(2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexanol Formula: C19H24N4O4S MolecularWeight: 404.48326

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1CC(CCC1NC2=NC(=NC3=C2C=CN3)C4=CC=CC=C4)O

Isomeric SMILES

CS(=O)(=O)O.C1CC(CCC1NC2=NC(=NC3=C2C=CN3)C4=CC=CC=C4)O

InChI

InChI=1S/C18H20N4O.CH4O3S/c23-14-8-6-13(7-9-14)20-18-15-10-11-19-17(15)21-16(22-18)12-4-2-1-3-5-12;1-5(2,3)4/h1-5,10-11,13-14,23H,6-9H2,(H2,19,20,21,22);1H3,(H,2,3,4)