ethyl 5-[2-(4-bromophenyl)ethyl]-2-sulfanylidene-piperidine-3-carboxylate

Systemtic Name: ethyl 5-[2-(4-bromophenyl)ethyl]-2-sulfanylidene-piperidine-3-carboxylate Openeye Name: ethyl 5-[2-(4-bromophenyl)ethyl]-2-thioxo-piperidine-3-carboxylate CAS Name: 5-[2-(4-bromophenyl)ethyl]-2-sulfanylidene-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-bromophenyl)ethyl]-2-sulfanylidenepiperidine-3-carboxylate Traditional Name: 5-[2-(4-bromophenyl)ethyl]-2-thioxo-nipecotic acid ethyl ester Formula: C16H20BrNO2S MolecularWeight: 370.3045

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(CNC1=S)CCC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)C1CC(CNC1=S)CCC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H20BrNO2S/c1-2-20-16(19)14-9-12(10-18-15(14)21)4-3-11-5-7-13(17)8-6-11/h5-8,12,14H,2-4,9-10H2,1H3,(H,18,21)