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

Systemtic Name: 3-[2-[(5-methoxy-2-methyl-phenyl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]-N-methyl-benzenesulfonamide Openeye Name: 3-[2-(5-methoxy-2-methyl-anilino)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methyl-benzenesulfonamide CAS Name: 3-[2-(5-methoxy-2-methylanilino)-7-pyrrolo[2,3-d]pyrimidinyl]-N-methylbenzenesulfonamide IUPAC Name: 3-[2-(5-methoxy-2-methylanilino)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methylbenzenesulfonamide Traditional Name: 3-[2-(5-methoxy-2-methyl-anilino)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methyl-benzenesulfonamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC)NC2=NC=C3C=CN(C3=N2)C4=CC(=CC=C4)S(=O)(=O)NC

Isomeric SMILES

CC1=C(C=C(C=C1)OC)NC2=NC=C3C=CN(C3=N2)C4=CC(=CC=C4)S(=O)(=O)NC

InChI

InChI=1S/C21H21N5O3S/c1-14-7-8-17(29-3)12-19(14)24-21-23-13-15-9-10-26(20(15)25-21)16-5-4-6-18(11-16)30(27,28)22-2/h4-13,22H,1-3H3,(H,23,24,25)