ethyl 3-[4-(3-sulfamoylpyridin-4-yl)piperazin-1-yl]-8-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: ethyl 3-[4-(3-sulfamoylpyridin-4-yl)piperazin-1-yl]-8-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: ethyl 3-[4-(3-sulfamoyl-4-pyridyl)piperazin-1-yl]-8-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: 3-[4-(3-sulfamoyl-4-pyridinyl)-1-piperazinyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(3-sulfamoylpyridin-4-yl)piperazin-1-yl]-8-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: 3-[4-(3-sulfamoyl-4-pyridyl)piperazino]-8-azabicyclo[3.2.1]octane-8-carboxylic acid ethyl ester Formula: C19H29N5O4S MolecularWeight: 423.52966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2CCC1CC(C2)N3CCN(CC3)C4=C(C=NC=C4)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)N1C2CCC1CC(C2)N3CCN(CC3)C4=C(C=NC=C4)S(=O)(=O)N

InChI

InChI=1S/C19H29N5O4S/c1-2-28-19(25)24-14-3-4-15(24)12-16(11-14)22-7-9-23(10-8-22)17-5-6-21-13-18(17)29(20,26)27/h5-6,13-16H,2-4,7-12H2,1H3,(H2,20,26,27)