2-[1-[(5-bromanyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-(3-fluorophenyl)-5-methyl-quinazolin-4-one

Systemtic Name: 2-[1-[(5-bromanyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-(3-fluorophenyl)-5-methyl-quinazolin-4-one Openeye Name: 2-[1-[(5-bromo-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-(3-fluorophenyl)-5-methyl-quinazolin-4-one CAS Name: 2-[1-[(5-bromo-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-(3-fluorophenyl)-5-methyl-4-quinazolinone IUPAC Name: 2-[1-[(5-bromo-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-(3-fluorophenyl)-5-methylquinazolin-4-one Traditional Name: 2-[1-[(5-bromo-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-(3-fluorophenyl)-5-methyl-quinazolin-4-one Formula: C23H18BrFN6O MolecularWeight: 493.331023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC(=CC=C3)F)C(C)NC4=NC=NC5=C4C(=CN5)Br

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC(=CC=C3)F)C(C)NC4=NC=NC5=C4C(=CN5)Br

InChI

InChI=1S/C23H18BrFN6O/c1-12-5-3-8-17-18(12)23(32)31(15-7-4-6-14(25)9-15)22(30-17)13(2)29-21-19-16(24)10-26-20(19)27-11-28-21/h3-11,13H,1-2H3,(H2,26,27,28,29)