ethyl 2-[[1,1-bis(oxidanylidene)thian-4-yl]carbonyl-(4-bromophenyl)amino]ethanoate

Systemtic Name: ethyl 2-[[1,1-bis(oxidanylidene)thian-4-yl]carbonyl-(4-bromophenyl)amino]ethanoate Openeye Name: ethyl 2-(4-bromo-N-(1,1-dioxothiane-4-carbonyl)anilino)acetate CAS Name: 2-(4-bromo-N-[(1,1-dioxo-4-thianyl)-oxomethyl]anilino)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-bromo-N-(1,1-dioxothiane-4-carbonyl)anilino)acetate Traditional Name: 2-(4-bromo-N-(1,1-diketothiane-4-carbonyl)anilino)acetic acid ethyl ester Formula: C16H20BrNO5S MolecularWeight: 418.3027

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=C(C=C1)Br)C(=O)C2CCS(=O)(=O)CC2

Isomeric SMILES

CCOC(=O)CN(C1=CC=C(C=C1)Br)C(=O)C2CCS(=O)(=O)CC2

InChI

InChI=1S/C16H20BrNO5S/c1-2-23-15(19)11-18(14-5-3-13(17)4-6-14)16(20)12-7-9-24(21,22)10-8-12/h3-6,12H,2,7-11H2,1H3