ethyl 4-[[4-oxidanylidene-3-(2-phenoxyethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methylamino]benzoate

Systemtic Name: ethyl 4-[[4-oxidanylidene-3-(2-phenoxyethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methylamino]benzoate Openeye Name: ethyl 4-[[4-oxo-3-(2-phenoxyethyl)-2-thioxo-thiazolidin-5-ylidene]methylamino]benzoate CAS Name: 4-[[4-oxo-3-(2-phenoxyethyl)-2-sulfanylidene-5-thiazolidinylidene]methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-oxo-3-(2-phenoxyethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methylamino]benzoate Traditional Name: 4-[[4-keto-3-(2-phenoxyethyl)-2-thioxo-thiazolidin-5-ylidene]methylamino]benzoic acid ethyl ester Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)N(C(=S)S2)CCOC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)N(C(=S)S2)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O4S2/c1-2-26-20(25)15-8-10-16(11-9-15)22-14-18-19(24)23(21(28)29-18)12-13-27-17-6-4-3-5-7-17/h3-11,14,22H,2,12-13H2,1H3