N-[4-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]propanamide

Systemtic Name: N-[4-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]propanamide Openeye Name: N-[4-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]propanamide CAS Name: N-[4-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]propanamide IUPAC Name: N-[4-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]propanamide Traditional Name: N-[4-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]propionamide Formula: C23H23N5O MolecularWeight: 385.46162

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=CC3=C(N2)N=CN=C3NC(C)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=CC3=C(N2)N=CN=C3NC(C)C4=CC=CC=C4

InChI

InChI=1S/C23H23N5O/c1-3-21(29)27-18-11-9-17(10-12-18)20-13-19-22(24-14-25-23(19)28-20)26-15(2)16-7-5-4-6-8-16/h4-15H,3H2,1-2H3,(H,27,29)(H2,24,25,26,28)