5-bromanyl-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[[(3-hydroxy-2-naphthalenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[(3-hydroxy-2-naphthoyl)amino]thiocarbamoyl]-2-furamide Formula: C17H12BrN3O4S MolecularWeight: 434.26388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C(=CC2=C1)C(=O)NNC(=S)NC(=O)C3=CC=C(O3)Br)O

Isomeric SMILES

C1=CC=C2C=C(C(=CC2=C1)C(=O)NNC(=S)NC(=O)C3=CC=C(O3)Br)O

InChI

InChI=1S/C17H12BrN3O4S/c18-14-6-5-13(25-14)16(24)19-17(26)21-20-15(23)11-7-9-3-1-2-4-10(9)8-12(11)22/h1-8,22H,(H,20,23)(H2,19,21,24,26)