ethyl 4-[[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate

Systemtic Name: ethyl 4-[[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[(5E)-5-(1,3-benzodioxol-5-ylmethylene)-3-methyl-4-oxo-thiazolidin-2-ylidene]amino]benzoate CAS Name: 4-[[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-methyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate Traditional Name: 4-[[(5E)-4-keto-3-methyl-5-piperonylidene-thiazolidin-2-ylidene]amino]benzoic acid ethyl ester Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)C(=CC3=CC4=C(C=C3)OCO4)S2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)/C(=C\C3=CC4=C(C=C3)OCO4)/S2)C

InChI

InChI=1S/C21H18N2O5S/c1-3-26-20(25)14-5-7-15(8-6-14)22-21-23(2)19(24)18(29-21)11-13-4-9-16-17(10-13)28-12-27-16/h4-11H,3,12H2,1-2H3/b18-11+,22-21?