N-[2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-(4-keto-6-propyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-3-(trifluoromethyl)benzamide Formula: C22H18F3N5O2S MolecularWeight: 473.47083

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H18F3N5O2S/c1-2-5-15-11-19(31)28-21(26-15)30-18(12-16(29-30)17-8-4-9-33-17)27-20(32)13-6-3-7-14(10-13)22(23,24)25/h3-4,6-12H,2,5H2,1H3,(H,27,32)(H,26,28,31)