4-[[(2E)-2-cyano-2-[3-(3-methoxypropyl)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]ethanoyl]amino]benzoate

Systemtic Name: 4-[[(2E)-2-cyano-2-[3-(3-methoxypropyl)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]ethanoyl]amino]benzoate Openeye Name: 4-[[(2E)-2-cyano-2-[3-(3-methoxypropyl)-4-oxo-thiazolidin-2-ylidene]acetyl]amino]benzoate CAS Name: 4-[[(2E)-2-cyano-2-[3-(3-methoxypropyl)-4-oxo-2-thiazolidinylidene]-1-oxoethyl]amino]benzoate IUPAC Name: 4-[[(2E)-2-cyano-2-[3-(3-methoxypropyl)-4-oxo-1,3-thiazolidin-2-ylidene]acetyl]amino]benzoate Traditional Name: 4-[[(2E)-2-cyano-2-[4-keto-3-(3-methoxypropyl)thiazolidin-2-ylidene]acetyl]amino]benzoate Formula: C17H16N3O5S- MolecularWeight: 374.39104

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)CSC1=C(C#N)C(=O)NC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

COCCCN\1C(=O)CS/C1=C(\C#N)/C(=O)NC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c1-25-8-2-7-20-14(21)10-26-16(20)13(9-18)15(22)19-12-5-3-11(4-6-12)17(23)24/h3-6H,2,7-8,10H2,1H3,(H,19,22)(H,23,24)/p-1/b16-13+