tert-butyl 4-[5-[(4-chlorophenyl)sulfonylamino]pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-[(4-chlorophenyl)sulfonylamino]pyridin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-[(4-chlorophenyl)sulfonylamino]-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[5-[(4-chlorophenyl)sulfonylamino]-2-pyridinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-[(4-chlorophenyl)sulfonylamino]pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[5-[(4-chlorophenyl)sulfonylamino]-2-pyridyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H25ClN4O4S MolecularWeight: 452.9549

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H25ClN4O4S/c1-20(2,3)29-19(26)25-12-10-24(11-13-25)18-9-6-16(14-22-18)23-30(27,28)17-7-4-15(21)5-8-17/h4-9,14,23H,10-13H2,1-3H3