5-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1H-pyrazole-4-carboxamide Openeye Name: 5-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1H-pyrazole-4-carboxamide CAS Name: 5-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylthio]ethyl]-1H-pyrazole-4-carboxamide IUPAC Name: 5-(4-fluorophenyl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1H-pyrazole-4-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide Formula: C19H17F2N3OS MolecularWeight: 373.419586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)F

InChI

InChI=1S/C19H17F2N3OS/c20-15-7-5-13(6-8-15)18-16(11-23-24-18)19(25)22-9-10-26-12-14-3-1-2-4-17(14)21/h1-8,11H,9-10,12H2,(H,22,25)(H,23,24)