3-[4-azanyl-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methyl-cyclobutane-1-carboxamide

Systemtic Name: 3-[4-azanyl-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methyl-cyclobutane-1-carboxamide Openeye Name: 3-[4-amino-5-(3-benzyloxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methyl-cyclobutanecarboxamide CAS Name: 3-[4-amino-5-(3-phenylmethoxyphenyl)-7-pyrrolo[2,3-d]pyrimidinyl]-N-methyl-1-cyclobutanecarboxamide IUPAC Name: 3-[4-amino-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methylcyclobutane-1-carboxamide Traditional Name: 3-[4-amino-5-(3-benzoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methyl-cyclobutanecarboxamide Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CNC(=O)C1CC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C25H25N5O2/c1-27-25(31)18-10-19(11-18)30-13-21(22-23(26)28-15-29-24(22)30)17-8-5-9-20(12-17)32-14-16-6-3-2-4-7-16/h2-9,12-13,15,18-19H,10-11,14H2,1H3,(H,27,31)(H2,26,28,29)