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

Systemtic Name: 3-[2-[[2-(phenethylcarbamoylamino)-1,3-thiazol-4-yl]carbonylamino]ethanoylamino]-3-phenyl-propanoic acid Openeye Name: 3-[[2-[[2-(phenethylcarbamoylamino)thiazole-4-carbonyl]amino]acetyl]amino]-3-phenyl-propanoic acid CAS Name: 3-[[1-oxo-2-[[oxo-[2-[[oxo-(phenethylamino)methyl]amino]-4-thiazolyl]methyl]amino]ethyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-[[2-[[2-(phenethylcarbamoylamino)-1,3-thiazole-4-carbonyl]amino]acetyl]amino]-3-phenylpropanoic acid Traditional Name: 3-[[2-[[2-(phenethylcarbamoylamino)thiazole-4-carbonyl]amino]acetyl]amino]-3-phenyl-propionic acid Formula: C24H25N5O5S MolecularWeight: 495.5508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)NC2=NC(=CS2)C(=O)NCC(=O)NC(CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)NC2=NC(=CS2)C(=O)NCC(=O)NC(CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C24H25N5O5S/c30-20(27-18(13-21(31)32)17-9-5-2-6-10-17)14-26-22(33)19-15-35-24(28-19)29-23(34)25-12-11-16-7-3-1-4-8-16/h1-10,15,18H,11-14H2,(H,26,33)(H,27,30)(H,31,32)(H2,25,28,29,34)