ethyl 4-[1-(5-bromanylthiophen-2-yl)sulfonylpiperidin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-(5-bromanylthiophen-2-yl)sulfonylpiperidin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-[(5-bromo-2-thienyl)sulfonyl]piperidine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-[(5-bromo-2-thiophenyl)sulfonyl]-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(5-bromothiophen-2-yl)sulfonylpiperidine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-[(5-bromo-2-thienyl)sulfonyl]isonipecotoyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H24BrN3O5S2 MolecularWeight: 494.42356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H24BrN3O5S2/c1-2-26-17(23)20-11-9-19(10-12-20)16(22)13-5-7-21(8-6-13)28(24,25)15-4-3-14(18)27-15/h3-4,13H,2,5-12H2,1H3