N-(1,2-diphenylethyl)-2-(4-fluorophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(1,2-diphenylethyl)-2-(4-fluorophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-(1,2-diphenylethyl)-2-(4-fluorophenyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-(1,2-diphenylethyl)-2-(4-fluorophenyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(1,2-diphenylethyl)-2-(4-fluorophenyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-(1,2-diphenylethyl)-2-(4-fluorophenyl)-5-(2-thienyl)pyrazole-3-carboxamide Formula: C28H22FN3OS MolecularWeight: 467.557183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=CC=CC=C2)NC(=O)C3=CC(=NN3C4=CC=C(C=C4)F)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CC(C2=CC=CC=C2)NC(=O)C3=CC(=NN3C4=CC=C(C=C4)F)C5=CC=CS5

InChI

InChI=1S/C28H22FN3OS/c29-22-13-15-23(16-14-22)32-26(19-25(31-32)27-12-7-17-34-27)28(33)30-24(21-10-5-2-6-11-21)18-20-8-3-1-4-9-20/h1-17,19,24H,18H2,(H,30,33)