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

Systemtic Name: ethyl 3-[2-[[2-(phenethylcarbamoylamino)-1,3-thiazol-4-yl]carbonylamino]ethanoylamino]-3-phenyl-propanoate Openeye Name: ethyl 3-[[2-[[2-(phenethylcarbamoylamino)thiazole-4-carbonyl]amino]acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[1-oxo-2-[[oxo-[2-[[oxo-(phenethylamino)methyl]amino]-4-thiazolyl]methyl]amino]ethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[[2-(phenethylcarbamoylamino)-1,3-thiazole-4-carbonyl]amino]acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-[[2-(phenethylcarbamoylamino)thiazole-4-carbonyl]amino]acetyl]amino]-3-phenyl-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)NCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)NC(=O)CNC(=O)C2=CSC(=N2)NC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C26H29N5O5S/c1-2-36-23(33)15-20(19-11-7-4-8-12-19)29-22(32)16-28-24(34)21-17-37-26(30-21)31-25(35)27-14-13-18-9-5-3-6-10-18/h3-12,17,20H,2,13-16H2,1H3,(H,28,34)(H,29,32)(H2,27,30,31,35)