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

Systemtic Name: 2-[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[[2-[2-(3-methoxyphenyl)thiazol-4-yl]acetyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[2-[2-(3-methoxyphenyl)-4-thiazolyl]-1-oxoethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]acetyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[2-[2-(3-methoxyphenyl)thiazol-4-yl]acetyl]amino]-3-methyl-valeric acid Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O4S/c1-4-11(2)16(18(22)23)20-15(21)9-13-10-25-17(19-13)12-6-5-7-14(8-12)24-3/h5-8,10-11,16H,4,9H2,1-3H3,(H,20,21)(H,22,23)