1-[4-[(1-oxidanyl-5-oxidanylidene-pyrido[2,3-d]pyrimidin-4-yl)amino]phenyl]-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[4-[(1-oxidanyl-5-oxidanylidene-pyrido[2,3-d]pyrimidin-4-yl)amino]phenyl]-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea Openeye Name: 1-[4-[(1-hydroxy-5-oxo-pyrido[2,3-d]pyrimidin-4-yl)amino]phenyl]-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea CAS Name: 1-[4-[(1-hydroxy-5-oxo-4-pyrido[2,3-d]pyrimidinyl)amino]phenyl]-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[4-[(1-hydroxy-5-oxopyrido[2,3-d]pyrimidin-4-yl)amino]phenyl]-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea Traditional Name: 1-[4-[(1-hydroxy-5-keto-pyrido[2,3-d]pyrimidin-4-yl)amino]phenyl]-3-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]urea Formula: C23H16F3N9O3 MolecularWeight: 523.42685

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C3C(=O)C=CN=C3N(C=N2)O)NC(=O)NC4=C(C=CC(=C4)C(F)(F)F)N5C=NC=N5

Isomeric SMILES

C1=CC(=CC=C1NC2=C3C(=O)C=CN=C3N(C=N2)O)NC(=O)NC4=C(C=CC(=C4)C(F)(F)F)N5C=NC=N5

InChI

InChI=1S/C23H16F3N9O3/c24-23(25,26)13-1-6-17(34-11-27-10-30-34)16(9-13)33-22(37)32-15-4-2-14(3-5-15)31-20-19-18(36)7-8-28-21(19)35(38)12-29-20/h1-12,31,38H,(H2,32,33,37)