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

Systemtic Name: N-[4-[(3-chloranyl-4-iodanyl-phenyl)carbamothioylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[(3-chloro-4-iodo-phenyl)carbamothioylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[(3-chloro-4-iodoanilino)-sulfanylidenemethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[(3-chloro-4-iodophenyl)carbamothioylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[(3-chloro-4-iodo-phenyl)thiocarbamoylamino]phenyl]-2-fluoro-benzamide Formula: C20H14ClFIN3OS MolecularWeight: 525.765533

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC3=CC(=C(C=C3)I)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC3=CC(=C(C=C3)I)Cl)F

InChI

InChI=1S/C20H14ClFIN3OS/c21-16-11-14(9-10-18(16)23)26-20(28)25-13-7-5-12(6-8-13)24-19(27)15-3-1-2-4-17(15)22/h1-11H,(H,24,27)(H2,25,26,28)