N-[3-[[3-(4-fluorophenyl)sulfanylpropanoylamino]methyl]phenyl]cyclobutanecarboxamide

Systemtic Name: N-[3-[[3-(4-fluorophenyl)sulfanylpropanoylamino]methyl]phenyl]cyclobutanecarboxamide Openeye Name: N-[3-[[3-(4-fluorophenyl)sulfanylpropanoylamino]methyl]phenyl]cyclobutanecarboxamide CAS Name: N-[3-[[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]methyl]phenyl]cyclobutanecarboxamide IUPAC Name: N-[3-[[3-(4-fluorophenyl)sulfanylpropanoylamino]methyl]phenyl]cyclobutanecarboxamide Traditional Name: N-[3-[[3-[(4-fluorophenyl)thio]propanoylamino]methyl]phenyl]cyclobutanecarboxamide Formula: C21H23FN2O2S MolecularWeight: 386.482923

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC2=CC=CC(=C2)CNC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

C1CC(C1)C(=O)NC2=CC=CC(=C2)CNC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN2O2S/c22-17-7-9-19(10-8-17)27-12-11-20(25)23-14-15-3-1-6-18(13-15)24-21(26)16-4-2-5-16/h1,3,6-10,13,16H,2,4-5,11-12,14H2,(H,23,25)(H,24,26)