N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-(4-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-(4-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-(4-fluorophenyl)sulfanyl-acetamide CAS Name: N-(5-cyclopropyl-2-phenyl-3-pyrazolyl)-2-[(4-fluorophenyl)thio]acetamide IUPAC Name: N-(5-cyclopropyl-2-phenylpyrazol-3-yl)-2-(4-fluorophenyl)sulfanylacetamide Traditional Name: N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-[(4-fluorophenyl)thio]acetamide Formula: C20H18FN3OS MolecularWeight: 367.439823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)NC(=O)CSC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NN(C(=C2)NC(=O)CSC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C20H18FN3OS/c21-15-8-10-17(11-9-15)26-13-20(25)22-19-12-18(14-6-7-14)23-24(19)16-4-2-1-3-5-16/h1-5,8-12,14H,6-7,13H2,(H,22,25)