1-[3-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)carbonylphenyl]-3-[3,4-bis(fluoranyl)phenyl]urea

Systemtic Name: 1-[3-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)carbonylphenyl]-3-[3,4-bis(fluoranyl)phenyl]urea Openeye Name: 1-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-(3,4-difluorophenyl)urea CAS Name: 1-[3-[(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-oxomethyl]phenyl]-3-(3,4-difluorophenyl)urea IUPAC Name: 1-[3-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-(3,4-difluorophenyl)urea Traditional Name: 1-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-(3,4-difluorophenyl)urea Formula: C23H20F2N6O2 MolecularWeight: 450.440706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=C1N=CN=C2N)C(=O)C3=CC(=CC=C3)NC(=O)NC4=CC(=C(C=C4)F)F

Isomeric SMILES

CC(C)N1C=C(C2=C1N=CN=C2N)C(=O)C3=CC(=CC=C3)NC(=O)NC4=CC(=C(C=C4)F)F

InChI

InChI=1S/C23H20F2N6O2/c1-12(2)31-10-16(19-21(26)27-11-28-22(19)31)20(32)13-4-3-5-14(8-13)29-23(33)30-15-6-7-17(24)18(25)9-15/h3-12H,1-2H3,(H2,26,27,28)(H2,29,30,33)