3,3-dimethyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide

Systemtic Name: 3,3-dimethyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide Openeye Name: 3,3-dimethyl-N-(5-nitrothiazol-2-yl)butanamide CAS Name: 3,3-dimethyl-N-(5-nitro-2-thiazolyl)butanamide IUPAC Name: 3,3-dimethyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide Traditional Name: 3,3-dimethyl-N-(5-nitrothiazol-2-yl)butyramide Formula: C9H13N3O3S MolecularWeight: 243.28282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=NC=C(S1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CC(=O)NC1=NC=C(S1)[N+](=O)[O-]

InChI

InChI=1S/C9H13N3O3S/c1-9(2,3)4-6(13)11-8-10-5-7(16-8)12(14)15/h5H,4H2,1-3H3,(H,10,11,13)