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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

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