ethyl 4-[[(2Z)-2-(4-methylphenyl)sulfonylimino-4-oxidanylidene-1,3-thiazolidin-3-yl]methylamino]benzoate

Systemtic Name: ethyl 4-[[(2Z)-2-(4-methylphenyl)sulfonylimino-4-oxidanylidene-1,3-thiazolidin-3-yl]methylamino]benzoate Openeye Name: ethyl 4-[[(2Z)-4-oxo-2-(p-tolylsulfonylimino)thiazolidin-3-yl]methylamino]benzoate CAS Name: 4-[[(2Z)-2-(4-methylphenyl)sulfonylimino-4-oxo-3-thiazolidinyl]methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2Z)-2-(4-methylphenyl)sulfonylimino-4-oxo-1,3-thiazolidin-3-yl]methylamino]benzoate Traditional Name: 4-[[(2Z)-4-keto-2-tosylimino-thiazolidin-3-yl]methylamino]benzoic acid ethyl ester Formula: C20H21N3O5S2 MolecularWeight: 447.52784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCN2C(=O)CSC2=NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCN\2C(=O)CS/C2=N\S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H21N3O5S2/c1-3-28-19(25)15-6-8-16(9-7-15)21-13-23-18(24)12-29-20(23)22-30(26,27)17-10-4-14(2)5-11-17/h4-11,21H,3,12-13H2,1-2H3/b22-20-