6-oxidanylidene-1-(phenylmethyl)-4-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrimidin-2-olate

Systemtic Name: 6-oxidanylidene-1-(phenylmethyl)-4-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrimidin-2-olate Openeye Name: 1-benzyl-6-oxo-4-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrimidin-2-olate CAS Name: 6-oxo-4-[oxo-[4-(trifluoromethyl)anilino]methyl]-1-(phenylmethyl)-2-pyrimidinolate IUPAC Name: 1-benzyl-6-oxo-4-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrimidin-2-olate Traditional Name: 1-benzyl-6-keto-4-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrimidin-2-olate Formula: C19H13F3N3O3- MolecularWeight: 388.32003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C=C(N=C2[O-])C(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C=C(N=C2[O-])C(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H14F3N3O3/c20-19(21,22)13-6-8-14(9-7-13)23-17(27)15-10-16(26)25(18(28)24-15)11-12-4-2-1-3-5-12/h1-10H,11H2,(H,23,27)(H,24,28)/p-1