N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]-2-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]-2-(2-phenoxyethoxy)benzamide Openeye Name: N-[[(3-nitrobenzoyl)amino]carbamothioyl]-2-(2-phenoxyethoxy)benzamide CAS Name: N-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[(3-nitrobenzoyl)amino]carbamothioyl]-2-(2-phenoxyethoxy)benzamide Traditional Name: N-[[(3-nitrobenzoyl)amino]thiocarbamoyl]-2-(2-phenoxyethoxy)benzamide Formula: C23H20N4O6S MolecularWeight: 480.4931

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=CC=C2C(=O)NC(=S)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=CC=C2C(=O)NC(=S)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O6S/c28-21(16-7-6-8-17(15-16)27(30)31)25-26-23(34)24-22(29)19-11-4-5-12-20(19)33-14-13-32-18-9-2-1-3-10-18/h1-12,15H,13-14H2,(H,25,28)(H2,24,26,29,34)