2-[[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]pteridin-4-yl]amino]ethanol

Systemtic Name: 2-[[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]pteridin-4-yl]amino]ethanol Openeye Name: 2-[[2-(3-chloro-4-fluoro-anilino)pteridin-4-yl]amino]ethanol CAS Name: 2-[[2-(3-chloro-4-fluoroanilino)-4-pteridinyl]amino]ethanol IUPAC Name: 2-[[2-(3-chloro-4-fluoroanilino)pteridin-4-yl]amino]ethanol Traditional Name: 2-[[2-(3-chloro-4-fluoro-anilino)pteridin-4-yl]amino]ethanol Formula: C14H12ClFN6O MolecularWeight: 334.736083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC3=NC=CN=C3C(=N2)NCCO)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC3=NC=CN=C3C(=N2)NCCO)Cl)F

InChI

InChI=1S/C14H12ClFN6O/c15-9-7-8(1-2-10(9)16)20-14-21-12-11(17-3-4-18-12)13(22-14)19-5-6-23/h1-4,7,23H,5-6H2,(H2,18,19,20,21,22)