ethyl 4-[(E)-(4-oxidanylidene-2-phenylimino-3-propyl-1,3-thiazolidin-5-ylidene)methyl]benzoate

Systemtic Name: ethyl 4-[(E)-(4-oxidanylidene-2-phenylimino-3-propyl-1,3-thiazolidin-5-ylidene)methyl]benzoate Openeye Name: ethyl 4-[(E)-(4-oxo-2-phenylimino-3-propyl-thiazolidin-5-ylidene)methyl]benzoate CAS Name: 4-[(E)-(4-oxo-2-phenylimino-3-propyl-5-thiazolidinylidene)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(E)-(4-oxo-2-phenylimino-3-propyl-1,3-thiazolidin-5-ylidene)methyl]benzoate Traditional Name: 4-[(E)-(4-keto-2-phenylimino-3-propyl-thiazolidin-5-ylidene)methyl]benzoic acid ethyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CC2=CC=C(C=C2)C(=O)OCC)SC1=NC3=CC=CC=C3

Isomeric SMILES

CCCN1C(=O)/C(=C\C2=CC=C(C=C2)C(=O)OCC)/SC1=NC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O3S/c1-3-14-24-20(25)19(28-22(24)23-18-8-6-5-7-9-18)15-16-10-12-17(13-11-16)21(26)27-4-2/h5-13,15H,3-4,14H2,1-2H3/b19-15+,23-22?