3-[[(5Z)-3-methyl-4-oxidanylidene-5-[(4-propoxyphenyl)methylidene]-1,3-thiazolidin-2-ylidene]amino]benzoic acid

Systemtic Name: 3-[[(5Z)-3-methyl-4-oxidanylidene-5-[(4-propoxyphenyl)methylidene]-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 3-[[(5Z)-3-methyl-4-oxo-5-[(4-propoxyphenyl)methylene]thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 3-[[(5Z)-3-methyl-4-oxo-5-[(4-propoxyphenyl)methylidene]-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 3-[[(5Z)-3-methyl-4-oxo-5-[(4-propoxyphenyl)methylidene]-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 3-[[(5Z)-4-keto-3-methyl-5-(4-propoxybenzylidene)thiazolidin-2-ylidene]amino]benzoic acid Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C2C(=O)N(C(=NC3=CC=CC(=C3)C(=O)O)S2)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=NC3=CC=CC(=C3)C(=O)O)S2)C

InChI

InChI=1S/C21H20N2O4S/c1-3-11-27-17-9-7-14(8-10-17)12-18-19(24)23(2)21(28-18)22-16-6-4-5-15(13-16)20(25)26/h4-10,12-13H,3,11H2,1-2H3,(H,25,26)/b18-12-,22-21?