ethyl 4-[2-(2-phenacylsulfanyl-1,3-thiazol-4-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(2-phenacylsulfanyl-1,3-thiazol-4-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(2-phenacylsulfanylthiazol-4-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[2-(phenacylthio)-4-thiazolyl]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2-phenacylsulfanyl-1,3-thiazol-4-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-[2-(phenacylthio)thiazol-4-yl]acetyl]amino]benzoic acid ethyl ester Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H20N2O4S2/c1-2-28-21(27)16-8-10-17(11-9-16)23-20(26)12-18-13-29-22(24-18)30-14-19(25)15-6-4-3-5-7-15/h3-11,13H,2,12,14H2,1H3,(H,23,26)