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

Systemtic Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 2-cyclopentylethanoate Openeye Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxo-ethyl] 2-cyclopentylacetate CAS Name: 2-cyclopentylacetic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxoethyl] 2-cyclopentylacetate Traditional Name: 2-cyclopentylacetic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-keto-ethyl] ester Formula: C17H22BrNO3S MolecularWeight: 400.33048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22BrNO3S/c18-14-5-7-15(8-6-14)23-10-9-19-16(20)12-22-17(21)11-13-3-1-2-4-13/h5-8,13H,1-4,9-12H2,(H,19,20)