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

Systemtic Name: 3-[[(5Z)-3-methyl-4-oxidanylidene-5-[(4-prop-2-ynoxyphenyl)methylidene]-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 3-[[(5Z)-3-methyl-4-oxo-5-[(4-prop-2-ynoxyphenyl)methylene]thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 3-[[(5Z)-3-methyl-4-oxo-5-[(4-prop-2-ynoxyphenyl)methylidene]-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 3-[[(5Z)-3-methyl-4-oxo-5-[(4-prop-2-ynoxyphenyl)methylidene]-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 3-[[(5Z)-4-keto-3-methyl-5-(4-propargyloxybenzylidene)thiazolidin-2-ylidene]amino]benzoic acid Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=C(C=C2)OCC#C)SC1=NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CN1C(=O)/C(=C/C2=CC=C(C=C2)OCC#C)/SC1=NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C21H16N2O4S/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/h1,4-10,12-13H,11H2,2H3,(H,25,26)/b18-12-,22-21?