2-[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[2-(3-methoxyphenyl)thiazol-4-yl]acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[2-(3-methoxyphenyl)-4-thiazolyl]-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[2-(3-methoxyphenyl)thiazol-4-yl]acetyl]amino]-3-methyl-butyric acid Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CC1=CSC(=N1)C2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CC1=CSC(=N1)C2=CC(=CC=C2)OC

InChI

InChI=1S/C17H20N2O4S/c1-10(2)15(17(21)22)19-14(20)8-12-9-24-16(18-12)11-5-4-6-13(7-11)23-3/h4-7,9-10,15H,8H2,1-3H3,(H,19,20)(H,21,22)