3-bromanyl-4-tert-butyl-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-tert-butyl-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-bromo-4-tert-butyl-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-tert-butyl-N-[[[(3-hydroxy-2-naphthalenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-tert-butyl-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-tert-butyl-N-[[(3-hydroxy-2-naphthoyl)amino]thiocarbamoyl]benzamide Formula: C23H22BrN3O3S MolecularWeight: 500.40808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC3=CC=CC=C3C=C2O)Br

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC3=CC=CC=C3C=C2O)Br

InChI

InChI=1S/C23H22BrN3O3S/c1-23(2,3)17-9-8-15(11-18(17)24)20(29)25-22(31)27-26-21(30)16-10-13-6-4-5-7-14(13)12-19(16)28/h4-12,28H,1-3H3,(H,26,30)(H2,25,27,29,31)