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

Systemtic Name: N-(5-methyl-1,3-thiazol-2-yl)-2,4-dinitro-benzamide Openeye Name: N-(5-methylthiazol-2-yl)-2,4-dinitro-benzamide CAS Name: N-(5-methyl-2-thiazolyl)-2,4-dinitrobenzamide IUPAC Name: N-(5-methyl-1,3-thiazol-2-yl)-2,4-dinitrobenzamide Traditional Name: N-(5-methylthiazol-2-yl)-2,4-dinitro-benzamide Formula: C11H8N4O5S MolecularWeight: 308.27002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(S1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H8N4O5S/c1-6-5-12-11(21-6)13-10(16)8-3-2-7(14(17)18)4-9(8)15(19)20/h2-5H,1H3,(H,12,13,16)