N-[4-[[3-chloranyl-4-(2-methylpropoxy)phenyl]carbamothioylamino]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[[3-chloranyl-4-(2-methylpropoxy)phenyl]carbamothioylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[(3-chloro-4-isobutoxy-phenyl)carbamothioylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[[3-chloro-4-(2-methylpropoxy)anilino]-sulfanylidenemethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[[3-chloro-4-(2-methylpropoxy)phenyl]carbamothioylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[(3-chloro-4-isobutoxy-phenyl)thiocarbamoylamino]phenyl]-2-fluoro-benzamide Formula: C24H23ClFN3O2S MolecularWeight: 471.974723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F)Cl

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F)Cl

InChI

InChI=1S/C24H23ClFN3O2S/c1-15(2)14-31-22-12-11-18(13-20(22)25)29-24(32)28-17-9-7-16(8-10-17)27-23(30)19-5-3-4-6-21(19)26/h3-13,15H,14H2,1-2H3,(H,27,30)(H2,28,29,32)