N-[4-[1-(4-bromanyl-2-fluoranyl-phenyl)ethylcarbamothioylamino]phenyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[4-[1-(4-bromanyl-2-fluoranyl-phenyl)ethylcarbamothioylamino]phenyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[4-[1-(4-bromo-2-fluoro-phenyl)ethylcarbamothioylamino]phenyl]thiazole-4-carboxamide CAS Name: N-[4-[[[1-(4-bromo-2-fluorophenyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-4-thiazolecarboxamide IUPAC Name: N-[4-[1-(4-bromo-2-fluorophenyl)ethylcarbamothioylamino]phenyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[4-[1-(4-bromo-2-fluoro-phenyl)ethylthiocarbamoylamino]phenyl]thiazole-4-carboxamide Formula: C19H16BrFN4OS2 MolecularWeight: 479.388943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Br)F)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CSC=N3

Isomeric SMILES

CC(C1=C(C=C(C=C1)Br)F)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CSC=N3

InChI

InChI=1S/C19H16BrFN4OS2/c1-11(15-7-2-12(20)8-16(15)21)23-19(27)25-14-5-3-13(4-6-14)24-18(26)17-9-28-10-22-17/h2-11H,1H3,(H,24,26)(H2,23,25,27)