[2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] cyclopentanecarboxylate

Systemtic Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] cyclopentanecarboxylate Openeye Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxo-ethyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxoethyl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-keto-ethyl] ester Formula: C16H20BrNO3S MolecularWeight: 386.3039

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)OCC(=O)NCCSC2=CC=C(C=C2)Br

Isomeric SMILES

C1CCC(C1)C(=O)OCC(=O)NCCSC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H20BrNO3S/c17-13-5-7-14(8-6-13)22-10-9-18-15(19)11-21-16(20)12-3-1-2-4-12/h5-8,12H,1-4,9-11H2,(H,18,19)