3-nitro-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3-nitro-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]benzamide Openeye Name: N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]-3-nitro-benzamide CAS Name: N-[[[(3-hydroxy-2-naphthalenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]-3-nitrobenzamide Traditional Name: N-[[(3-hydroxy-2-naphthoyl)amino]thiocarbamoyl]-3-nitro-benzamide Formula: C19H14N4O5S MolecularWeight: 410.40326

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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(=CC=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C=C(C(=CC2=C1)C(=O)NNC(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])O

InChI

InChI=1S/C19H14N4O5S/c24-16-10-12-5-2-1-4-11(12)9-15(16)18(26)21-22-19(29)20-17(25)13-6-3-7-14(8-13)23(27)28/h1-10,24H,(H,21,26)(H2,20,22,25,29)