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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=NC=C(S2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=NC=C(S2)[N+](=O)[O-])[N+](=O)[O-]

InChI

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