ethyl 4-[[1-(5-bromanylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(5-bromanylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-[(5-bromo-2-thienyl)sulfonyl]pyrrolidine-2-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[1-[(5-bromo-2-thiophenyl)sulfonyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(5-bromothiophen-2-yl)sulfonylpyrrolidine-2-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-[(5-bromo-2-thienyl)sulfonyl]prolyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C17H24BrN3O5S2 MolecularWeight: 494.42356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H24BrN3O5S2/c1-2-26-17(23)20-10-7-12(8-11-20)19-16(22)13-4-3-9-21(13)28(24,25)15-6-5-14(18)27-15/h5-6,12-13H,2-4,7-11H2,1H3,(H,19,22)