2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide Formula: C14H12FN5O3S MolecularWeight: 349.340183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=NC3=C(S2)C=C(C=C3)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=NC3=C(S2)C=C(C=C3)F)C)[N+](=O)[O-]

InChI

InChI=1S/C14H12FN5O3S/c1-7-13(20(22)23)8(2)19(18-7)6-12(21)17-14-16-10-4-3-9(15)5-11(10)24-14/h3-5H,6H2,1-2H3,(H,16,17,21)