N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenyl-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenyl-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenyl-5-(2-thienyl)pyrazole-3-carboxamide Formula: C21H13FN4OS2 MolecularWeight: 420.482523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC5=C(S4)C=C(C=C5)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC5=C(S4)C=C(C=C5)F

InChI

InChI=1S/C21H13FN4OS2/c22-13-8-9-15-19(11-13)29-21(23-15)24-20(27)17-12-16(18-7-4-10-28-18)25-26(17)14-5-2-1-3-6-14/h1-12H,(H,23,24,27)