N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[[(2-nitrobenzoyl)amino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[[[(2-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[(2-nitrobenzoyl)amino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[[(2-nitrobenzoyl)amino]thiocarbamoyl]-4-(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=C(C=C2)C(=O)NC(=S)NNC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C(=O)NC(=S)NNC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

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