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

Systemtic Name: 3,5-dinitro-N-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 3,5-dinitro-N-[4-(4-phenoxyphenyl)thiazol-2-yl]benzamide CAS Name: 3,5-dinitro-N-[4-(4-phenoxyphenyl)-2-thiazolyl]benzamide IUPAC Name: 3,5-dinitro-N-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]benzamide Traditional Name: 3,5-dinitro-N-[4-(4-phenoxyphenyl)thiazol-2-yl]benzamide Formula: C22H14N4O6S MolecularWeight: 462.43476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H14N4O6S/c27-21(15-10-16(25(28)29)12-17(11-15)26(30)31)24-22-23-20(13-33-22)14-6-8-19(9-7-14)32-18-4-2-1-3-5-18/h1-13H,(H,23,24,27)