4-[2-[3-(2,2-dimethoxyethyl)-4-oxidanylidene-2-phenylimino-1,3-thiazolidin-5-yl]ethanoylamino]benzoic acid

Systemtic Name: 4-[2-[3-(2,2-dimethoxyethyl)-4-oxidanylidene-2-phenylimino-1,3-thiazolidin-5-yl]ethanoylamino]benzoic acid Openeye Name: 4-[[2-[3-(2,2-dimethoxyethyl)-4-oxo-2-phenylimino-thiazolidin-5-yl]acetyl]amino]benzoic acid CAS Name: 4-[[2-[3-(2,2-dimethoxyethyl)-4-oxo-2-phenylimino-5-thiazolidinyl]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-[3-(2,2-dimethoxyethyl)-4-oxo-2-phenylimino-1,3-thiazolidin-5-yl]acetyl]amino]benzoic acid Traditional Name: 4-[[2-[3-(2,2-dimethoxyethyl)-4-keto-2-phenylimino-thiazolidin-5-yl]acetyl]amino]benzoic acid Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1C(=O)C(SC1=NC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)C(=O)O)OC

Isomeric SMILES

COC(CN1C(=O)C(SC1=NC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C22H23N3O6S/c1-30-19(31-2)13-25-20(27)17(32-22(25)24-15-6-4-3-5-7-15)12-18(26)23-16-10-8-14(9-11-16)21(28)29/h3-11,17,19H,12-13H2,1-2H3,(H,23,26)(H,28,29)