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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=CC=C1C(C)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

InChI

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