ethyl 1-[5-chloranyl-2-[2-(4-ethanoylpiperazin-1-yl)ethanoylamino]phenyl]sulfonylpyrrole-2-carboxylate

Systemtic Name: ethyl 1-[5-chloranyl-2-[2-(4-ethanoylpiperazin-1-yl)ethanoylamino]phenyl]sulfonylpyrrole-2-carboxylate Openeye Name: ethyl 1-[2-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-5-chloro-phenyl]sulfonylpyrrole-2-carboxylate CAS Name: 1-[2-[[2-(4-acetyl-1-piperazinyl)-1-oxoethyl]amino]-5-chlorophenyl]sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-5-chlorophenyl]sulfonylpyrrole-2-carboxylate Traditional Name: 1-[2-[[2-(4-acetylpiperazino)acetyl]amino]-5-chloro-phenyl]sulfonylpyrrole-2-carboxylic acid ethyl ester Formula: C21H25ClN4O6S MolecularWeight: 496.9644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)NC(=O)CN3CCN(CC3)C(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)NC(=O)CN3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H25ClN4O6S/c1-3-32-21(29)18-5-4-8-26(18)33(30,31)19-13-16(22)6-7-17(19)23-20(28)14-24-9-11-25(12-10-24)15(2)27/h4-8,13H,3,9-12,14H2,1-2H3,(H,23,28)