N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-2-methyl-3,5-dinitro-benzamide

Systemtic Name: N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-2-methyl-3,5-dinitro-benzamide Openeye Name: N-(5-ethyl-4-phenyl-thiazol-2-yl)-2-methyl-3,5-dinitro-benzamide CAS Name: N-(5-ethyl-4-phenyl-2-thiazolyl)-2-methyl-3,5-dinitrobenzamide IUPAC Name: N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-2-methyl-3,5-dinitrobenzamide Traditional Name: N-(5-ethyl-4-phenyl-thiazol-2-yl)-2-methyl-3,5-dinitro-benzamide Formula: C19H16N4O5S MolecularWeight: 412.41914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)NC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCC1=C(N=C(S1)NC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H16N4O5S/c1-3-16-17(12-7-5-4-6-8-12)20-19(29-16)21-18(24)14-9-13(22(25)26)10-15(11(14)2)23(27)28/h4-10H,3H2,1-2H3,(H,20,21,24)