N-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dinitro-benzamide

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dinitro-benzamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-3,5-dinitro-benzamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-3,5-dinitrobenzamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dinitrobenzamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-3,5-dinitro-benzamide Formula: C12H10N4O5S MolecularWeight: 322.2966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C12H10N4O5S/c1-6-7(2)22-12(13-6)14-11(17)8-3-9(15(18)19)5-10(4-8)16(20)21/h3-5H,1-2H3,(H,13,14,17)