[2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate

Systemtic Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate Openeye Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxo-ethyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxoethyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-keto-ethyl] ester Formula: C16H22BrNO3S MolecularWeight: 388.31978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OCC(=O)NCCSC1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)(C)CC(=O)OCC(=O)NCCSC1=CC=C(C=C1)Br

InChI

InChI=1S/C16H22BrNO3S/c1-16(2,3)10-15(20)21-11-14(19)18-8-9-22-13-6-4-12(17)5-7-13/h4-7H,8-11H2,1-3H3,(H,18,19)