N-[(2,4-dichlorophenyl)methylcarbamothioyl]-3,5-dinitro-benzamide

Systemtic Name: N-[(2,4-dichlorophenyl)methylcarbamothioyl]-3,5-dinitro-benzamide Openeye Name: N-[(2,4-dichlorophenyl)methylcarbamothioyl]-3,5-dinitro-benzamide CAS Name: N-[[(2,4-dichlorophenyl)methylamino]-sulfanylidenemethyl]-3,5-dinitrobenzamide IUPAC Name: N-[(2,4-dichlorophenyl)methylcarbamothioyl]-3,5-dinitrobenzamide Traditional Name: N-[(2,4-dichlorobenzyl)thiocarbamoyl]-3,5-dinitro-benzamide Formula: C15H10Cl2N4O5S MolecularWeight: 429.2347

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CNC(=S)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CNC(=S)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H10Cl2N4O5S/c16-10-2-1-8(13(17)5-10)7-18-15(27)19-14(22)9-3-11(20(23)24)6-12(4-9)21(25)26/h1-6H,7H2,(H2,18,19,22,27)