N6-[2-(7-fluoranyl-2,4-dimethyl-1H-indol-3-yl)ethyl]-N4-isoquinolin-3-yl-pyrimidine-4,6-diamine

Systemtic Name: N6-[2-(7-fluoranyl-2,4-dimethyl-1H-indol-3-yl)ethyl]-N4-isoquinolin-3-yl-pyrimidine-4,6-diamine Openeye Name: N6-[2-(7-fluoro-2,4-dimethyl-1H-indol-3-yl)ethyl]-N4-(3-isoquinolyl)pyrimidine-4,6-diamine CAS Name: N6-[2-(7-fluoro-2,4-dimethyl-1H-indol-3-yl)ethyl]-N4-(3-isoquinolinyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-[2-(7-fluoro-2,4-dimethyl-1H-indol-3-yl)ethyl]-4-N-isoquinolin-3-ylpyrimidine-4,6-diamine Traditional Name: 2-(7-fluoro-2,4-dimethyl-1H-indol-3-yl)ethyl-[6-(3-isoquinolylamino)pyrimidin-4-yl]amine Formula: C25H23FN6 MolecularWeight: 426.488723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(NC2=C(C=C1)F)C)CCNC3=NC=NC(=C3)NC4=CC5=CC=CC=C5C=N4

Isomeric SMILES

CC1=C2C(=C(NC2=C(C=C1)F)C)CCNC3=NC=NC(=C3)NC4=CC5=CC=CC=C5C=N4

InChI

InChI=1S/C25H23FN6/c1-15-7-8-20(26)25-24(15)19(16(2)31-25)9-10-27-21-12-23(30-14-29-21)32-22-11-17-5-3-4-6-18(17)13-28-22/h3-8,11-14,31H,9-10H2,1-2H3,(H2,27,28,29,30,32)