N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-3-(1-phenylpyrazol-4-yl)propionamide Formula: C21H22FN3OS MolecularWeight: 383.482283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CCC(=O)NCCSCC3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CCC(=O)NCCSCC3=CC=CC=C3F

InChI

InChI=1S/C21H22FN3OS/c22-20-9-5-4-6-18(20)16-27-13-12-23-21(26)11-10-17-14-24-25(15-17)19-7-2-1-3-8-19/h1-9,14-15H,10-13,16H2,(H,23,26)