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

Systemtic Name: (5-pyridin-4-ylpyrimidin-2-yl) 4-[(3-acetyloxy-5-chloranyl-1H-indol-2-yl)sulfonyl]piperazine-1-carboxylate Openeye Name: [5-(4-pyridyl)pyrimidin-2-yl] 4-[(3-acetoxy-5-chloro-1H-indol-2-yl)sulfonyl]piperazine-1-carboxylate CAS Name: 4-[(3-acetyloxy-5-chloro-1H-indol-2-yl)sulfonyl]-1-piperazinecarboxylic acid (5-pyridin-4-yl-2-pyrimidinyl) ester IUPAC Name: (5-pyridin-4-ylpyrimidin-2-yl) 4-[(3-acetyloxy-5-chloro-1H-indol-2-yl)sulfonyl]piperazine-1-carboxylate Traditional Name: 4-[(3-acetoxy-5-chloro-1H-indol-2-yl)sulfonyl]piperazine-1-carboxylic acid [5-(4-pyridyl)pyrimidin-2-yl] ester Formula: C24H21ClN6O6S MolecularWeight: 556.97814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(NC2=C1C=C(C=C2)Cl)S(=O)(=O)N3CCN(CC3)C(=O)OC4=NC=C(C=N4)C5=CC=NC=C5

Isomeric SMILES

CC(=O)OC1=C(NC2=C1C=C(C=C2)Cl)S(=O)(=O)N3CCN(CC3)C(=O)OC4=NC=C(C=N4)C5=CC=NC=C5

InChI

InChI=1S/C24H21ClN6O6S/c1-15(32)36-21-19-12-18(25)2-3-20(19)29-22(21)38(34,35)31-10-8-30(9-11-31)24(33)37-23-27-13-17(14-28-23)16-4-6-26-7-5-16/h2-7,12-14,29H,8-11H2,1H3