N-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-(1-oxidanylcyclohexyl)ethanamide

Systemtic Name: N-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-(1-oxidanylcyclohexyl)ethanamide Openeye Name: N-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-(1-hydroxycyclohexyl)acetamide CAS Name: N-[4-amino-5-(4-phenoxyphenyl)-7-pyrrolo[2,3-d]pyrimidinyl]-2-(1-hydroxycyclohexyl)acetamide IUPAC Name: N-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-(1-hydroxycyclohexyl)acetamide Traditional Name: N-[4-amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-(1-hydroxycyclohexyl)acetamide Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NN2C=C(C3=C2N=CN=C3N)C4=CC=C(C=C4)OC5=CC=CC=C5)O

Isomeric SMILES

C1CCC(CC1)(CC(=O)NN2C=C(C3=C2N=CN=C3N)C4=CC=C(C=C4)OC5=CC=CC=C5)O

InChI

InChI=1S/C26H27N5O3/c27-24-23-21(18-9-11-20(12-10-18)34-19-7-3-1-4-8-19)16-31(25(23)29-17-28-24)30-22(32)15-26(33)13-5-2-6-14-26/h1,3-4,7-12,16-17,33H,2,5-6,13-15H2,(H,30,32)(H2,27,28,29)