ethyl 1-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methyl-sulfamoyl]phenyl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methyl-sulfamoyl]phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-methyl-sulfamoyl]benzoyl]piperidine-3-carboxylate CAS Name: 1-[[3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-methylsulfamoyl]phenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-methylsulfamoyl]benzoyl]piperidine-3-carboxylate Traditional Name: 1-[3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-methyl-sulfamoyl]benzoyl]nipecotic acid ethyl ester Formula: C27H32N4O6S MolecularWeight: 540.63118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C27H32N4O6S/c1-5-37-27(34)21-12-10-16-30(18-21)25(32)20-11-9-15-23(17-20)38(35,36)29(4)24-19(2)28(3)31(26(24)33)22-13-7-6-8-14-22/h6-9,11,13-15,17,21H,5,10,12,16,18H2,1-4H3