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

Systemtic Name: N-[4-[1-(3-chloranyl-4-fluoranyl-phenyl)ethylcarbamothioylamino]phenyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[4-[1-(3-chloro-4-fluoro-phenyl)ethylcarbamothioylamino]phenyl]thiazole-4-carboxamide CAS Name: N-[4-[[[1-(3-chloro-4-fluorophenyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-4-thiazolecarboxamide IUPAC Name: N-[4-[1-(3-chloro-4-fluorophenyl)ethylcarbamothioylamino]phenyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[4-[1-(3-chloro-4-fluoro-phenyl)ethylthiocarbamoylamino]phenyl]thiazole-4-carboxamide Formula: C19H16ClFN4OS2 MolecularWeight: 434.937943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16ClFN4OS2/c1-11(12-2-7-16(21)15(20)8-12)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)