ethyl 4-[1-(5-chloranylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-(5-chloranylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-[(5-chloro-2-thiophenyl)sulfonyl]-2-pyrrolidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(5-chlorothiophen-2-yl)sulfonylpyrrolidine-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-[(5-chloro-2-thienyl)sulfonyl]prolyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H22ClN3O5S2 MolecularWeight: 435.94598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H22ClN3O5S2/c1-2-25-16(22)19-10-8-18(9-11-19)15(21)12-4-3-7-20(12)27(23,24)14-6-5-13(17)26-14/h5-6,12H,2-4,7-11H2,1H3