4-[2-[2-(4-bromophenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-yl]ethanoylamino]benzoic acid

Systemtic Name: 4-[2-[2-(4-bromophenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-yl]ethanoylamino]benzoic acid Openeye Name: 4-[[2-[3-allyl-2-(4-bromophenyl)imino-4-oxo-thiazolidin-5-yl]acetyl]amino]benzoic acid CAS Name: 4-[[2-[2-(4-bromophenyl)imino-4-oxo-3-prop-2-enyl-5-thiazolidinyl]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-[2-(4-bromophenyl)imino-4-oxo-3-prop-2-enyl-1,3-thiazolidin-5-yl]acetyl]amino]benzoic acid Traditional Name: 4-[[2-[3-allyl-2-(4-bromophenyl)imino-4-keto-thiazolidin-5-yl]acetyl]amino]benzoic acid Formula: C21H18BrN3O4S MolecularWeight: 488.35432

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(SC1=NC2=CC=C(C=C2)Br)CC(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C=CCN1C(=O)C(SC1=NC2=CC=C(C=C2)Br)CC(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H18BrN3O4S/c1-2-11-25-19(27)17(30-21(25)24-16-9-5-14(22)6-10-16)12-18(26)23-15-7-3-13(4-8-15)20(28)29/h2-10,17H,1,11-12H2,(H,23,26)(H,28,29)