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

Systemtic Name: N-[4-(4-methylphenyl)-5-phenyl-1,3-thiazol-2-yl]-2,4-dinitro-benzamide Openeye Name: 2,4-dinitro-N-[5-phenyl-4-(p-tolyl)thiazol-2-yl]benzamide CAS Name: N-[4-(4-methylphenyl)-5-phenyl-2-thiazolyl]-2,4-dinitrobenzamide IUPAC Name: N-[4-(4-methylphenyl)-5-phenyl-1,3-thiazol-2-yl]-2,4-dinitrobenzamide Traditional Name: 2,4-dinitro-N-[5-phenyl-4-(p-tolyl)thiazol-2-yl]benzamide Formula: C23H16N4O5S MolecularWeight: 460.46194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H16N4O5S/c1-14-7-9-15(10-8-14)20-21(16-5-3-2-4-6-16)33-23(24-20)25-22(28)18-12-11-17(26(29)30)13-19(18)27(31)32/h2-13H,1H3,(H,24,25,28)