2-(4-fluorophenyl)carbonyl-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]benzamide

Systemtic Name: 2-(4-fluorophenyl)carbonyl-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]benzamide Openeye Name: 2-(4-fluorobenzoyl)-N-[2-(3-thienylmethylsulfanyl)ethyl]benzamide CAS Name: 2-[(4-fluorophenyl)-oxomethyl]-N-[2-(3-thiophenylmethylthio)ethyl]benzamide IUPAC Name: 2-(4-fluorobenzoyl)-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]benzamide Traditional Name: 2-(4-fluorobenzoyl)-N-[2-(3-thenylthio)ethyl]benzamide Formula: C21H18FNO2S2 MolecularWeight: 399.501523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)F)C(=O)NCCSCC3=CSC=C3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)F)C(=O)NCCSCC3=CSC=C3

InChI

InChI=1S/C21H18FNO2S2/c22-17-7-5-16(6-8-17)20(24)18-3-1-2-4-19(18)21(25)23-10-12-27-14-15-9-11-26-13-15/h1-9,11,13H,10,12,14H2,(H,23,25)