N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C15H15N5O4S MolecularWeight: 361.3757

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=NC3=C(S2)C=C(C=C3)OCC

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=NC3=C(S2)C=C(C=C3)OCC

InChI

InChI=1S/C15H15N5O4S/c1-3-19-13(11(8-16-19)20(22)23)14(21)18-15-17-10-6-5-9(24-4-2)7-12(10)25-15/h5-8H,3-4H2,1-2H3,(H,17,18,21)