N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]-2-nitro-benzamide Openeye Name: N-[(3,5-dichloro-4-hydroxy-phenyl)carbamothioyl]-2-nitro-benzamide CAS Name: N-[(3,5-dichloro-4-hydroxyanilino)-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]-2-nitrobenzamide Traditional Name: N-[(3,5-dichloro-4-hydroxy-phenyl)thiocarbamoyl]-2-nitro-benzamide Formula: C14H9Cl2N3O4S MolecularWeight: 386.20996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC(=C(C(=C2)Cl)O)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC(=C(C(=C2)Cl)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H9Cl2N3O4S/c15-9-5-7(6-10(16)12(9)20)17-14(24)18-13(21)8-3-1-2-4-11(8)19(22)23/h1-6,20H,(H2,17,18,21,24)