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

Systemtic Name: 3-bromanyl-4-methoxy-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-bromo-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[[(3-hydroxy-2-naphthalenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[[(3-hydroxy-2-naphthoyl)amino]thiocarbamoyl]-4-methoxy-benzamide Formula: C20H16BrN3O4S MolecularWeight: 474.32774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC3=CC=CC=C3C=C2O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC3=CC=CC=C3C=C2O)Br

InChI

InChI=1S/C20H16BrN3O4S/c1-28-17-7-6-13(9-15(17)21)18(26)22-20(29)24-23-19(27)14-8-11-4-2-3-5-12(11)10-16(14)25/h2-10,25H,1H3,(H,23,27)(H2,22,24,26,29)