ethyl 3-chloranyl-4-[[4-(4-oxidanylidene-3-phenethyl-1,3-thiazolidin-2-yl)phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 3-chloranyl-4-[[4-(4-oxidanylidene-3-phenethyl-1,3-thiazolidin-2-yl)phenyl]carbonylamino]benzoate Openeye Name: ethyl 3-chloro-4-[[4-(4-oxo-3-phenethyl-thiazolidin-2-yl)benzoyl]amino]benzoate CAS Name: 3-chloro-4-[[oxo-[4-(4-oxo-3-phenethyl-2-thiazolidinyl)phenyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-chloro-4-[[4-(4-oxo-3-phenethyl-1,3-thiazolidin-2-yl)benzoyl]amino]benzoate Traditional Name: 3-chloro-4-[[4-(4-keto-3-phenethyl-thiazolidin-2-yl)benzoyl]amino]benzoic acid ethyl ester Formula: C27H25ClN2O4S MolecularWeight: 509.0164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)C3N(C(=O)CS3)CCC4=CC=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)C3N(C(=O)CS3)CCC4=CC=CC=C4)Cl

InChI

InChI=1S/C27H25ClN2O4S/c1-2-34-27(33)21-12-13-23(22(28)16-21)29-25(32)19-8-10-20(11-9-19)26-30(24(31)17-35-26)15-14-18-6-4-3-5-7-18/h3-13,16,26H,2,14-15,17H2,1H3,(H,29,32)