4-[[2-bromanyl-4-[(Z)-(3-methyl-2-methylimino-4-oxidanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoate

Systemtic Name: 4-[[2-bromanyl-4-[(Z)-(3-methyl-2-methylimino-4-oxidanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoate Openeye Name: 4-[[2-bromo-4-[(Z)-(3-methyl-2-methylimino-4-oxo-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-bromo-4-[(Z)-(3-methyl-2-methylimino-4-oxo-5-thiazolidinylidene)methyl]phenoxy]methyl]benzoate IUPAC Name: 4-[[2-bromo-4-[(Z)-(3-methyl-2-methylimino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoate Traditional Name: 4-[[2-bromo-4-[(Z)-(4-keto-3-methyl-2-methylimino-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoate Formula: C20H16BrN2O4S- MolecularWeight: 460.32104

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Descriptors Computed from Structure

Canonical SMILES:

CN=C1N(C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)[O-])Br)S1)C

Isomeric SMILES

CN=C1N(C(=O)/C(=C/C2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)[O-])Br)/S1)C

InChI

InChI=1S/C20H17BrN2O4S/c1-22-20-23(2)18(24)17(28-20)10-13-5-8-16(15(21)9-13)27-11-12-3-6-14(7-4-12)19(25)26/h3-10H,11H2,1-2H3,(H,25,26)/p-1/b17-10-,22-20?