5-phenyl-7-(4-propoxyphenyl)-N-(pyridin-3-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-phenyl-7-(4-propoxyphenyl)-N-(pyridin-3-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5-phenyl-7-(4-propoxyphenyl)-N-(3-pyridylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 5-phenyl-7-(4-propoxyphenyl)-N-(3-pyridinylmethyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 5-phenyl-7-(4-propoxyphenyl)-N-(pyridin-3-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [5-phenyl-7-(4-propoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C27H25N5O MolecularWeight: 435.5203

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NCC4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3NCC4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25N5O/c1-2-15-33-23-12-10-22(11-13-23)32-18-24(21-8-4-3-5-9-21)25-26(30-19-31-27(25)32)29-17-20-7-6-14-28-16-20/h3-14,16,18-19H,2,15,17H2,1H3,(H,29,30,31)