N-(3-chloranyl-4-fluoranyl-phenyl)-6-[4-(diethylaminomethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-[4-(diethylaminomethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6-[4-(diethylaminomethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6-[4-(diethylaminomethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-[4-(diethylaminomethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [4-[4-(3-chloro-4-fluoro-anilino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]benzyl]-diethyl-amine Formula: C23H23ClFN5 MolecularWeight: 423.913623

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)C2=CC3=C(N2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)C2=CC3=C(N2)N=CN=C3NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C23H23ClFN5/c1-3-30(4-2)13-15-5-7-16(8-6-15)21-12-18-22(26-14-27-23(18)29-21)28-17-9-10-20(25)19(24)11-17/h5-12,14H,3-4,13H2,1-2H3,(H2,26,27,28,29)