ethyl 3-phenyl-3-[2-[[2-(1-phenylethylcarbamoylamino)-1,3-thiazol-4-yl]carbonylamino]ethanoylamino]propanoate

Systemtic Name: ethyl 3-phenyl-3-[2-[[2-(1-phenylethylcarbamoylamino)-1,3-thiazol-4-yl]carbonylamino]ethanoylamino]propanoate Openeye Name: ethyl 3-phenyl-3-[[2-[[2-(1-phenylethylcarbamoylamino)thiazole-4-carbonyl]amino]acetyl]amino]propanoate CAS Name: 3-[[1-oxo-2-[[oxo-[2-[[oxo-(1-phenylethylamino)methyl]amino]-4-thiazolyl]methyl]amino]ethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 3-phenyl-3-[[2-[[2-(1-phenylethylcarbamoylamino)-1,3-thiazole-4-carbonyl]amino]acetyl]amino]propanoate Traditional Name: 3-phenyl-3-[[2-[[2-(1-phenylethylcarbamoylamino)thiazole-4-carbonyl]amino]acetyl]amino]propionic acid ethyl ester Formula: C26H29N5O5S MolecularWeight: 523.60396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)NC(=O)CNC(=O)C2=CSC(=N2)NC(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)NC(=O)CNC(=O)C2=CSC(=N2)NC(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C26H29N5O5S/c1-3-36-23(33)14-20(19-12-8-5-9-13-19)29-22(32)15-27-24(34)21-16-37-26(30-21)31-25(35)28-17(2)18-10-6-4-7-11-18/h4-13,16-17,20H,3,14-15H2,1-2H3,(H,27,34)(H,29,32)(H2,28,30,31,35)