2-[5-[(4-bromophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methyl-butanoic acid

Systemtic Name: 2-[5-[(4-bromophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methyl-butanoic acid Openeye Name: 2-[5-[(4-bromophenyl)methyl]-4-oxo-2-thioxo-thiazolidin-3-yl]-3-methyl-butanoic acid CAS Name: 2-[5-[(4-bromophenyl)methyl]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-methylbutanoic acid IUPAC Name: 2-[5-[(4-bromophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methylbutanoic acid Traditional Name: 2-[5-(4-bromobenzyl)-4-keto-2-thioxo-thiazolidin-3-yl]-3-methyl-butyric acid Formula: C15H16BrNO3S2 MolecularWeight: 402.32644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1C(=O)C(SC1=S)CC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)C(C(=O)O)N1C(=O)C(SC1=S)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H16BrNO3S2/c1-8(2)12(14(19)20)17-13(18)11(22-15(17)21)7-9-3-5-10(16)6-4-9/h3-6,8,11-12H,7H2,1-2H3,(H,19,20)