tert-butyl 4-[[2-methyl-5-(6-oxidanylidene-1H-pyridazin-3-yl)phenyl]sulfonylamino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-methyl-5-(6-oxidanylidene-1H-pyridazin-3-yl)phenyl]sulfonylamino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-methyl-5-(6-oxo-1H-pyridazin-3-yl)phenyl]sulfonylamino]piperidine-1-carboxylate CAS Name: 4-[[2-methyl-5-(6-oxo-1H-pyridazin-3-yl)phenyl]sulfonylamino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-methyl-5-(6-oxo-1H-pyridazin-3-yl)phenyl]sulfonylamino]piperidine-1-carboxylate Traditional Name: 4-[[5-(6-keto-1H-pyridazin-3-yl)-2-methyl-phenyl]sulfonylamino]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=O)C=C2)S(=O)(=O)NC3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=O)C=C2)S(=O)(=O)NC3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H28N4O5S/c1-14-5-6-15(17-7-8-19(26)23-22-17)13-18(14)31(28,29)24-16-9-11-25(12-10-16)20(27)30-21(2,3)4/h5-8,13,16,24H,9-12H2,1-4H3,(H,23,26)