methyl 6-[[(2R)-1-(5-bromanylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[(2R)-1-(5-bromanylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[[(2R)-1-[(5-bromo-2-thienyl)sulfonyl]pyrrolidine-2-carbonyl]amino]hexanoate CAS Name: 6-[[[(2R)-1-[(5-bromo-2-thiophenyl)sulfonyl]-2-pyrrolidinyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(2R)-1-(5-bromothiophen-2-yl)sulfonylpyrrolidine-2-carbonyl]amino]hexanoate Traditional Name: 6-[[(2R)-1-[(5-bromo-2-thienyl)sulfonyl]prolyl]amino]hexanoic acid methyl ester Formula: C16H23BrN2O5S2 MolecularWeight: 467.39822

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1CCCN1S(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC(=O)CCCCCNC(=O)[C@H]1CCCN1S(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C16H23BrN2O5S2/c1-24-14(20)7-3-2-4-10-18-16(21)12-6-5-11-19(12)26(22,23)15-9-8-13(17)25-15/h8-9,12H,2-7,10-11H2,1H3,(H,18,21)/t12-/m1/s1