N-[6-[2-fluoranyl-4-[(3-methyl-5-oxidanylidene-1-phenyl-2-propyl-pyrazol-4-yl)carbonylamino]phenoxy]pyrimidin-4-yl]morpholine-4-carboxamide

Systemtic Name: N-[6-[2-fluoranyl-4-[(3-methyl-5-oxidanylidene-1-phenyl-2-propyl-pyrazol-4-yl)carbonylamino]phenoxy]pyrimidin-4-yl]morpholine-4-carboxamide Openeye Name: N-[6-[2-fluoro-4-[(3-methyl-5-oxo-1-phenyl-2-propyl-pyrazole-4-carbonyl)amino]phenoxy]pyrimidin-4-yl]morpholine-4-carboxamide CAS Name: N-[6-[2-fluoro-4-[[(3-methyl-5-oxo-1-phenyl-2-propyl-4-pyrazolyl)-oxomethyl]amino]phenoxy]-4-pyrimidinyl]-4-morpholinecarboxamide IUPAC Name: N-[6-[2-fluoro-4-[(3-methyl-5-oxo-1-phenyl-2-propylpyrazole-4-carbonyl)amino]phenoxy]pyrimidin-4-yl]morpholine-4-carboxamide Traditional Name: N-[6-[2-fluoro-4-[(5-keto-3-methyl-1-phenyl-2-propyl-3-pyrazoline-4-carbonyl)amino]phenoxy]pyrimidin-4-yl]morpholine-4-carboxamide Formula: C29H30FN7O5 MolecularWeight: 575.590803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N1C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)OC4=NC=NC(=C4)NC(=O)N5CCOCC5)F)C

Isomeric SMILES

CCCN1C(=C(C(=O)N1C2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)OC4=NC=NC(=C4)NC(=O)N5CCOCC5)F)C

InChI

InChI=1S/C29H30FN7O5/c1-3-11-36-19(2)26(28(39)37(36)21-7-5-4-6-8-21)27(38)33-20-9-10-23(22(30)16-20)42-25-17-24(31-18-32-25)34-29(40)35-12-14-41-15-13-35/h4-10,16-18H,3,11-15H2,1-2H3,(H,33,38)(H,31,32,34,40)