N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-3,5-dinitro-benzamide Openeye Name: N-[4-(4-iodophenyl)thiazol-2-yl]-3,5-dinitro-benzamide CAS Name: N-[4-(4-iodophenyl)-2-thiazolyl]-3,5-dinitrobenzamide IUPAC Name: N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-3,5-dinitrobenzamide Traditional Name: N-[4-(4-iodophenyl)thiazol-2-yl]-3,5-dinitro-benzamide Formula: C16H9IN4O5S MolecularWeight: 496.23593

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])I

Isomeric SMILES

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])I

InChI

InChI=1S/C16H9IN4O5S/c17-11-3-1-9(2-4-11)14-8-27-16(18-14)19-15(22)10-5-12(20(23)24)7-13(6-10)21(25)26/h1-8H,(H,18,19,22)