ethyl 6-[4-(4-sulfamoylphenyl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-(4-sulfamoylphenyl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-(4-sulfamoylphenyl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-(4-sulfamoylphenyl)sulfonyl-1-piperazinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(4-sulfamoylphenyl)sulfonylpiperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-(4-sulfamoylphenyl)sulfonylpiperazino]nicotinic acid ethyl ester Formula: C18H22N4O6S2 MolecularWeight: 454.52048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H22N4O6S2/c1-2-28-18(23)14-3-8-17(20-13-14)21-9-11-22(12-10-21)30(26,27)16-6-4-15(5-7-16)29(19,24)25/h3-8,13H,2,9-12H2,1H3,(H2,19,24,25)