(2S)-2-[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[2-[2-(3-methoxyphenyl)thiazol-4-yl]acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[2-(3-methoxyphenyl)-4-thiazolyl]-1-oxoethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-[2-(3-methoxyphenyl)thiazol-4-yl]acetyl]amino]-3-phenyl-propionate Formula: C21H19N2O4S- MolecularWeight: 395.45156

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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)N[C@@H](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)/p-1/t18-/m0/s1