2-azanyl-3-[(E)-(3-pyrimidin-2-yloxyphenyl)methylideneamino]-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 2-azanyl-3-[(E)-(3-pyrimidin-2-yloxyphenyl)methylideneamino]-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 2-amino-3-[(E)-(3-pyrimidin-2-yloxyphenyl)methyleneamino]-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 2-amino-3-[(E)-[3-(2-pyrimidinyloxy)phenyl]methylideneamino]-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 2-amino-3-[(E)-(3-pyrimidin-2-yloxyphenyl)methylideneamino]-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 2-amino-3-[(E)-[3-(2-pyrimidyloxy)benzylidene]amino]-6-(trifluoromethyl)pyrimidin-4-one Formula: C16H11F3N6O2 MolecularWeight: 376.29275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=NC=CC=N2)C=NN3C(=O)C=C(N=C3N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)OC2=NC=CC=N2)/C=N/N3C(=O)C=C(N=C3N)C(F)(F)F

InChI

InChI=1S/C16H11F3N6O2/c17-16(18,19)12-8-13(26)25(14(20)24-12)23-9-10-3-1-4-11(7-10)27-15-21-5-2-6-22-15/h1-9H,(H2,20,24)/b23-9+