N-[4-[1-(1-benzothiophen-3-yl)ethylcarbamothioylamino]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[1-(1-benzothiophen-3-yl)ethylcarbamothioylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[1-(benzothiophen-3-yl)ethylcarbamothioylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[[1-(1-benzothiophen-3-yl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[1-(1-benzothiophen-3-yl)ethylcarbamothioylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[1-(benzothiophen-3-yl)ethylthiocarbamoylamino]phenyl]-2-fluoro-benzamide Formula: C24H20FN3OS2 MolecularWeight: 449.563503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CSC2=CC=CC=C21)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4F

Isomeric SMILES

CC(C1=CSC2=CC=CC=C21)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C24H20FN3OS2/c1-15(20-14-31-22-9-5-3-6-18(20)22)26-24(30)28-17-12-10-16(11-13-17)27-23(29)19-7-2-4-8-21(19)25/h2-15H,1H3,(H,27,29)(H2,26,28,30)