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

Systemtic Name: 4-[2-(3-cyclohexyl-2-methylimino-4-oxidanylidene-1,3-thiazolidin-5-yl)ethanoylamino]benzoic acid Openeye Name: 4-[[2-(3-cyclohexyl-2-methylimino-4-oxo-thiazolidin-5-yl)acetyl]amino]benzoic acid CAS Name: 4-[[2-(3-cyclohexyl-2-methylimino-4-oxo-5-thiazolidinyl)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-(3-cyclohexyl-2-methylimino-4-oxo-1,3-thiazolidin-5-yl)acetyl]amino]benzoic acid Traditional Name: 4-[[2-(3-cyclohexyl-4-keto-2-methylimino-thiazolidin-5-yl)acetyl]amino]benzoic acid Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CN=C1N(C(=O)C(S1)CC(=O)NC2=CC=C(C=C2)C(=O)O)C3CCCCC3

Isomeric SMILES

CN=C1N(C(=O)C(S1)CC(=O)NC2=CC=C(C=C2)C(=O)O)C3CCCCC3

InChI

InChI=1S/C19H23N3O4S/c1-20-19-22(14-5-3-2-4-6-14)17(24)15(27-19)11-16(23)21-13-9-7-12(8-10-13)18(25)26/h7-10,14-15H,2-6,11H2,1H3,(H,21,23)(H,25,26)