7-[chloranyl-bis(fluoranyl)methyl]-N-(4-ethoxy-2-nitro-phenyl)-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: 7-[chloranyl-bis(fluoranyl)methyl]-N-(4-ethoxy-2-nitro-phenyl)-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: 7-[chloro(difluoro)methyl]-N-(4-ethoxy-2-nitro-phenyl)-5-(2-thienyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: 7-[chloro(difluoro)methyl]-N-(4-ethoxy-2-nitrophenyl)-5-thiophen-2-yl-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 7-[chloro(difluoro)methyl]-N-(4-ethoxy-2-nitrophenyl)-5-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: 7-[chloro(difluoro)methyl]-N-(4-ethoxy-2-nitro-phenyl)-5-(2-thienyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C20H14ClF2N5O4S MolecularWeight: 493.871066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=NN3C(=CC(=NC3=C2)C4=CC=CS4)C(F)(F)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=NN3C(=CC(=NC3=C2)C4=CC=CS4)C(F)(F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H14ClF2N5O4S/c1-2-32-11-5-6-12(15(8-11)28(30)31)25-19(29)14-10-18-24-13(16-4-3-7-33-16)9-17(20(21,22)23)27(18)26-14/h3-10H,2H2,1H3,(H,25,29)