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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

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