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

Systemtic Name: 2-fluoranyl-N-[4-[1-(3-methylphenyl)ethylcarbamothioylamino]phenyl]benzamide Openeye Name: 2-fluoro-N-[4-[1-(m-tolyl)ethylcarbamothioylamino]phenyl]benzamide CAS Name: 2-fluoro-N-[4-[[[1-(3-methylphenyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2-fluoro-N-[4-[1-(3-methylphenyl)ethylcarbamothioylamino]phenyl]benzamide Traditional Name: 2-fluoro-N-[4-[1-(m-tolyl)ethylthiocarbamoylamino]phenyl]benzamide Formula: C23H22FN3OS MolecularWeight: 407.503683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=CC=C1)C(C)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C23H22FN3OS/c1-15-6-5-7-17(14-15)16(2)25-23(29)27-19-12-10-18(11-13-19)26-22(28)20-8-3-4-9-21(20)24/h3-14,16H,1-2H3,(H,26,28)(H2,25,27,29)