ethyl 6-oxidanylidene-1-phenyl-4-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]pyridazine-3-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-1-phenyl-4-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]pyridazine-3-carboxylate Openeye Name: ethyl 6-oxo-1-phenyl-4-[[4-(1-piperidylsulfonyl)benzoyl]amino]pyridazine-3-carboxylate CAS Name: 6-oxo-4-[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]amino]-1-phenyl-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-oxo-1-phenyl-4-[(4-piperidin-1-ylsulfonylbenzoyl)amino]pyridazine-3-carboxylate Traditional Name: 6-keto-1-phenyl-4-[(4-piperidinosulfonylbenzoyl)amino]pyridazine-3-carboxylic acid ethyl ester Formula: C25H26N4O6S MolecularWeight: 510.56214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O6S/c1-2-35-25(32)23-21(17-22(30)29(27-23)19-9-5-3-6-10-19)26-24(31)18-11-13-20(14-12-18)36(33,34)28-15-7-4-8-16-28/h3,5-6,9-14,17H,2,4,7-8,15-16H2,1H3,(H,26,31)