4-chloranyl-N-[(4-iodophenyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(4-iodophenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(4-iodophenyl)carbamothioyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(4-iodoanilino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(4-iodophenyl)carbamothioyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(4-iodophenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C14H9ClIN3O3S MolecularWeight: 461.66203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])I

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])I

InChI

InChI=1S/C14H9ClIN3O3S/c15-11-6-1-8(7-12(11)19(21)22)13(20)18-14(23)17-10-4-2-9(16)3-5-10/h1-7H,(H2,17,18,20,23)