3-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]pyrazine-2-carboxylate

Systemtic Name: 3-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]pyrazine-2-carboxylate Openeye Name: 3-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]pyrazine-2-carboxylate CAS Name: 3-[oxo-[4-[3-(trifluoromethyl)-1-pyrazolyl]anilino]methyl]-2-pyrazinecarboxylate IUPAC Name: 3-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]pyrazine-2-carboxylate Traditional Name: 3-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]carbamoyl]pyrazinate Formula: C16H9F3N5O3- MolecularWeight: 376.26957

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=NC=CN=C2C(=O)[O-])N3C=CC(=N3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=NC=CN=C2C(=O)[O-])N3C=CC(=N3)C(F)(F)F

InChI

InChI=1S/C16H10F3N5O3/c17-16(18,19)11-5-8-24(23-11)10-3-1-9(2-4-10)22-14(25)12-13(15(26)27)21-7-6-20-12/h1-8H,(H,22,25)(H,26,27)/p-1