N-[[(5-chloranyl-2-methoxy-phenyl)carbonylamino]carbamothioyl]-3,4-bis(fluoranyl)benzamide

Systemtic Name: N-[[(5-chloranyl-2-methoxy-phenyl)carbonylamino]carbamothioyl]-3,4-bis(fluoranyl)benzamide Openeye Name: N-[[(5-chloro-2-methoxy-benzoyl)amino]carbamothioyl]-3,4-difluoro-benzamide CAS Name: N-[[[(5-chloro-2-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3,4-difluorobenzamide IUPAC Name: N-[[(5-chloro-2-methoxybenzoyl)amino]carbamothioyl]-3,4-difluorobenzamide Traditional Name: N-[[(5-chloro-2-methoxy-benzoyl)amino]thiocarbamoyl]-3,4-difluoro-benzamide Formula: C16H12ClF2N3O3S MolecularWeight: 399.799586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C16H12ClF2N3O3S/c1-25-13-5-3-9(17)7-10(13)15(24)21-22-16(26)20-14(23)8-2-4-11(18)12(19)6-8/h2-7H,1H3,(H,21,24)(H2,20,22,23,26)