2-[2-[(5-methoxy-2-methyl-phenyl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]-N-propyl-benzenesulfonamide

Systemtic Name: 2-[2-[(5-methoxy-2-methyl-phenyl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]-N-propyl-benzenesulfonamide Openeye Name: 2-[2-(5-methoxy-2-methyl-anilino)pyrrolo[2,3-d]pyrimidin-7-yl]-N-propyl-benzenesulfonamide CAS Name: 2-[2-(5-methoxy-2-methylanilino)-7-pyrrolo[2,3-d]pyrimidinyl]-N-propylbenzenesulfonamide IUPAC Name: 2-[2-(5-methoxy-2-methylanilino)pyrrolo[2,3-d]pyrimidin-7-yl]-N-propylbenzenesulfonamide Traditional Name: 2-[2-(5-methoxy-2-methyl-anilino)pyrrolo[2,3-d]pyrimidin-7-yl]-N-propyl-benzenesulfonamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=CC=C1N2C=CC3=CN=C(N=C32)NC4=C(C=CC(=C4)OC)C

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=CC=C1N2C=CC3=CN=C(N=C32)NC4=C(C=CC(=C4)OC)C

InChI

InChI=1S/C23H25N5O3S/c1-4-12-25-32(29,30)21-8-6-5-7-20(21)28-13-11-17-15-24-23(27-22(17)28)26-19-14-18(31-3)10-9-16(19)2/h5-11,13-15,25H,4,12H2,1-3H3,(H,24,26,27)