2-methylpropyl 3-(4-bromophenyl)carbonyl-2-pentyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: 2-methylpropyl 3-(4-bromophenyl)carbonyl-2-pentyl-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl 3-(4-bromobenzoyl)-2-pentyl-thiazolidine-4-carboxylate CAS Name: 3-[(4-bromophenyl)-oxomethyl]-2-pentyl-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(4-bromobenzoyl)-2-pentyl-1,3-thiazolidine-4-carboxylate Traditional Name: 2-amyl-3-(4-bromobenzoyl)thiazolidine-4-carboxylic acid isobutyl ester Formula: C20H28BrNO3S MolecularWeight: 442.41022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1N(C(CS1)C(=O)OCC(C)C)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCC1N(C(CS1)C(=O)OCC(C)C)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H28BrNO3S/c1-4-5-6-7-18-22(19(23)15-8-10-16(21)11-9-15)17(13-26-18)20(24)25-12-14(2)3/h8-11,14,17-18H,4-7,12-13H2,1-3H3