(5-pyridin-4-ylpyrimidin-2-yl) 4-[(5-chloranyl-3-oxidanyl-1H-indol-2-yl)sulfonyl]piperazine-1-carboxylate

Systemtic Name: (5-pyridin-4-ylpyrimidin-2-yl) 4-[(5-chloranyl-3-oxidanyl-1H-indol-2-yl)sulfonyl]piperazine-1-carboxylate Openeye Name: [5-(4-pyridyl)pyrimidin-2-yl] 4-[(5-chloro-3-hydroxy-1H-indol-2-yl)sulfonyl]piperazine-1-carboxylate CAS Name: 4-[(5-chloro-3-hydroxy-1H-indol-2-yl)sulfonyl]-1-piperazinecarboxylic acid (5-pyridin-4-yl-2-pyrimidinyl) ester IUPAC Name: (5-pyridin-4-ylpyrimidin-2-yl) 4-[(5-chloro-3-hydroxy-1H-indol-2-yl)sulfonyl]piperazine-1-carboxylate Traditional Name: 4-[(5-chloro-3-hydroxy-1H-indol-2-yl)sulfonyl]piperazine-1-carboxylic acid [5-(4-pyridyl)pyrimidin-2-yl] ester Formula: C22H19ClN6O5S MolecularWeight: 514.94146

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)OC2=NC=C(C=N2)C3=CC=NC=C3)S(=O)(=O)C4=C(C5=C(N4)C=CC(=C5)Cl)O

Isomeric SMILES

C1CN(CCN1C(=O)OC2=NC=C(C=N2)C3=CC=NC=C3)S(=O)(=O)C4=C(C5=C(N4)C=CC(=C5)Cl)O

InChI

InChI=1S/C22H19ClN6O5S/c23-16-1-2-18-17(11-16)19(30)20(27-18)35(32,33)29-9-7-28(8-10-29)22(31)34-21-25-12-15(13-26-21)14-3-5-24-6-4-14/h1-6,11-13,27,30H,7-10H2