N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[1-(4-nitrophenyl)carbonyl-5-oxidanylidene-3-phenyl-4H-pyrazol-4-yl]-2-oxidanylidene-ethanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[1-(4-nitrophenyl)carbonyl-5-oxidanylidene-3-phenyl-4H-pyrazol-4-yl]-2-oxidanylidene-ethanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[1-(4-nitrobenzoyl)-5-oxo-3-phenyl-4H-pyrazol-4-yl]-2-oxo-acetamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[1-[(4-nitrophenyl)-oxomethyl]-5-oxo-3-phenyl-4H-pyrazol-4-yl]-2-oxoacetamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[1-(4-nitrobenzoyl)-5-oxo-3-phenyl-4H-pyrazol-4-yl]-2-oxoacetamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-keto-2-[5-keto-1-(4-nitrobenzoyl)-3-phenyl-2-pyrazolin-4-yl]acetamide Formula: C27H19N5O7S MolecularWeight: 557.53406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)C3C(=NN(C3=O)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)C3C(=NN(C3=O)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C27H19N5O7S/c1-2-39-18-12-13-19-20(14-18)40-27(28-19)29-24(34)23(33)21-22(15-6-4-3-5-7-15)30-31(26(21)36)25(35)16-8-10-17(11-9-16)32(37)38/h3-14,21H,2H2,1H3,(H,28,29,34)