5-[(3-bromanyl-4-butan-2-yloxy-phenyl)methylidene]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[(3-bromanyl-4-butan-2-yloxy-phenyl)methylidene]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1,3-thiazolidine-2,4-dione Openeye Name: 5-[(3-bromo-4-sec-butoxy-phenyl)methylene]-3-[2-oxo-2-(1-piperidyl)ethyl]thiazolidine-2,4-dione CAS Name: 5-[(3-bromo-4-butan-2-yloxyphenyl)methylidene]-3-[2-oxo-2-(1-piperidinyl)ethyl]thiazolidine-2,4-dione IUPAC Name: 5-[(3-bromo-4-butan-2-yloxyphenyl)methylidene]-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazolidine-2,4-dione Traditional Name: 5-(3-bromo-4-sec-butoxy-benzylidene)-3-(2-keto-2-piperidino-ethyl)thiazolidine-2,4-quinone Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)N3CCCCC3)Br

Isomeric SMILES

CCC(C)OC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)N3CCCCC3)Br

InChI

InChI=1S/C21H25BrN2O4S/c1-3-14(2)28-17-8-7-15(11-16(17)22)12-18-20(26)24(21(27)29-18)13-19(25)23-9-5-4-6-10-23/h7-8,11-12,14H,3-6,9-10,13H2,1-2H3