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

Systemtic Name: 2-[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[2-(3-methoxyphenyl)thiazol-4-yl]acetyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[2-(3-methoxyphenyl)-4-thiazolyl]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]acetyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[2-(3-methoxyphenyl)thiazol-4-yl]acetyl]amino]-3-phenyl-propionic acid Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC(=CS2)CC(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC(=CS2)CC(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H20N2O4S/c1-27-17-9-5-8-15(11-17)20-22-16(13-28-20)12-19(24)23-18(21(25)26)10-14-6-3-2-4-7-14/h2-9,11,13,18H,10,12H2,1H3,(H,23,24)(H,25,26)