1-(2-phenylpteridin-4-yl)-3-[4-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(2-phenylpteridin-4-yl)-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-(2-phenylpteridin-4-yl)-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-(2-phenyl-4-pteridinyl)-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(2-phenylpteridin-4-yl)-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-(2-phenylpteridin-4-yl)-3-[4-(trifluoromethyl)phenyl]urea Formula: C20H13F3N6O MolecularWeight: 410.35203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=NC=CN=C3C(=N2)NC(=O)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=NC=CN=C3C(=N2)NC(=O)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H13F3N6O/c21-20(22,23)13-6-8-14(9-7-13)26-19(30)29-18-15-17(25-11-10-24-15)27-16(28-18)12-4-2-1-3-5-12/h1-11H,(H2,25,26,27,28,29,30)