N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitro-pyrazol-1-yl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitropyrazol-1-yl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitro-pyrazol-1-yl)acetamide Formula: C13H11N5O3S MolecularWeight: 317.32314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC(=O)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O3S/c1-8-6-11(18(20)21)16-17(8)7-12(19)15-13-14-9-4-2-3-5-10(9)22-13/h2-6H,7H2,1H3,(H,14,15,19)