5-ethyl-1-(4-fluorophenyl)-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide

Systemtic Name: 5-ethyl-1-(4-fluorophenyl)-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide Openeye Name: 5-ethyl-1-(4-fluorophenyl)-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide CAS Name: 5-ethyl-1-(4-fluorophenyl)-N-[3-(phenylthio)propyl]-4-pyrazolecarboxamide IUPAC Name: 5-ethyl-1-(4-fluorophenyl)-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide Traditional Name: 5-ethyl-1-(4-fluorophenyl)-N-[3-(phenylthio)propyl]pyrazole-4-carboxamide Formula: C21H22FN3OS MolecularWeight: 383.482283

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C21H22FN3OS/c1-2-20-19(15-24-25(20)17-11-9-16(22)10-12-17)21(26)23-13-6-14-27-18-7-4-3-5-8-18/h3-5,7-12,15H,2,6,13-14H2,1H3,(H,23,26)