N-(2,4-dimethoxyphenyl)-7-(4-methylsulfonylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine

Systemtic Name: N-(2,4-dimethoxyphenyl)-7-(4-methylsulfonylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine Openeye Name: N-(2,4-dimethoxyphenyl)-7-(4-methylsulfonylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine CAS Name: N-(2,4-dimethoxyphenyl)-7-(4-methylsulfonylphenyl)-2-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: N-(2,4-dimethoxyphenyl)-7-(4-methylsulfonylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine Traditional Name: (2,4-dimethoxyphenyl)-[7-(4-mesylphenyl)pyrrolo[2,3-d]pyrimidin-2-yl]amine Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NC=C3C=CN(C3=N2)C4=CC=C(C=C4)S(=O)(=O)C)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NC=C3C=CN(C3=N2)C4=CC=C(C=C4)S(=O)(=O)C)OC

InChI

InChI=1S/C21H20N4O4S/c1-28-16-6-9-18(19(12-16)29-2)23-21-22-13-14-10-11-25(20(14)24-21)15-4-7-17(8-5-15)30(3,26)27/h4-13H,1-3H3,(H,22,23,24)