N-(2-acetamido-1,3-benzothiazol-6-yl)-2-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(2-acetamido-1,3-benzothiazol-6-yl)-2-methyl-4-nitro-pyrazole-3-carboxamide Formula: C14H12N6O4S MolecularWeight: 360.34788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(C=NN3C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(C=NN3C)[N+](=O)[O-]

InChI

InChI=1S/C14H12N6O4S/c1-7(21)16-14-18-9-4-3-8(5-11(9)25-14)17-13(22)12-10(20(23)24)6-15-19(12)2/h3-6H,1-2H3,(H,17,22)(H,16,18,21)