5-bromanyl-N-[[(4-phenylmethoxyphenyl)carbonylamino]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[(4-phenylmethoxyphenyl)carbonylamino]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[(4-benzyloxybenzoyl)amino]carbamothioyl]-5-bromo-furan-2-carboxamide CAS Name: 5-bromo-N-[[[oxo-(4-phenylmethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[(4-phenylmethoxybenzoyl)amino]carbamothioyl]furan-2-carboxamide Traditional Name: N-[[(4-benzoxybenzoyl)amino]thiocarbamoyl]-5-bromo-2-furamide Formula: C20H16BrN3O4S MolecularWeight: 474.32774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C20H16BrN3O4S/c21-17-11-10-16(28-17)19(26)22-20(29)24-23-18(25)14-6-8-15(9-7-14)27-12-13-4-2-1-3-5-13/h1-11H,12H2,(H,23,25)(H2,22,24,26,29)