N-[4-methoxy-3-(2-pyrrolidin-1-ylethoxy)phenyl]-7-(4-methylsulfonylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine

Systemtic Name: N-[4-methoxy-3-(2-pyrrolidin-1-ylethoxy)phenyl]-7-(4-methylsulfonylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine Openeye Name: N-[4-methoxy-3-(2-pyrrolidin-1-ylethoxy)phenyl]-7-(4-methylsulfonylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine CAS Name: N-[4-methoxy-3-[2-(1-pyrrolidinyl)ethoxy]phenyl]-7-(4-methylsulfonylphenyl)-2-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: N-[4-methoxy-3-(2-pyrrolidin-1-ylethoxy)phenyl]-7-(4-methylsulfonylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine Traditional Name: [7-(4-mesylphenyl)pyrrolo[2,3-d]pyrimidin-2-yl]-[4-methoxy-3-(2-pyrrolidinoethoxy)phenyl]amine Formula: C26H29N5O4S MolecularWeight: 507.60456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC=C3C=CN(C3=N2)C4=CC=C(C=C4)S(=O)(=O)C)OCCN5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC=C3C=CN(C3=N2)C4=CC=C(C=C4)S(=O)(=O)C)OCCN5CCCC5

InChI

InChI=1S/C26H29N5O4S/c1-34-23-10-5-20(17-24(23)35-16-15-30-12-3-4-13-30)28-26-27-18-19-11-14-31(25(19)29-26)21-6-8-22(9-7-21)36(2,32)33/h5-11,14,17-18H,3-4,12-13,15-16H2,1-2H3,(H,27,28,29)