1-[4-(4-azanyl-5-oxidanylidene-pyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[2-fluoranyl-5-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[4-(4-azanyl-5-oxidanylidene-pyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[2-fluoranyl-5-(trifluoromethyl)phenyl]urea Openeye Name: 1-[4-(4-amino-5-oxo-pyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea CAS Name: 1-[4-(4-amino-5-oxo-8-pyrido[2,3-d]pyrimidinyl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[4-(4-amino-5-oxopyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea Traditional Name: 1-[4-(4-amino-5-keto-pyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea Formula: C21H14F4N6O2 MolecularWeight: 458.368473

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)F)N3C=CC(=O)C4=C3N=CN=C4N

Isomeric SMILES

C1=CC(=CC=C1NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)F)N3C=CC(=O)C4=C3N=CN=C4N

InChI

InChI=1S/C21H14F4N6O2/c22-14-6-1-11(21(23,24)25)9-15(14)30-20(33)29-12-2-4-13(5-3-12)31-8-7-16(32)17-18(26)27-10-28-19(17)31/h1-10H,(H2,26,27,28)(H2,29,30,33)