2-[2-[2-[(4-methoxyphenyl)carbonyl-propan-2-yl-amino]ethanoylamino]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-[(4-methoxyphenyl)carbonyl-propan-2-yl-amino]ethanoylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[[2-[isopropyl-(4-methoxybenzoyl)amino]acetyl]amino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[2-[[(4-methoxyphenyl)-oxomethyl]-propan-2-ylamino]-1-oxoethyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[[2-[(4-methoxybenzoyl)-propan-2-ylamino]acetyl]amino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[2-[isopropyl(p-anisoyl)amino]acetyl]amino]thiazol-4-yl]acetic acid Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)NC1=NC(=CS1)CC(=O)O)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)N(CC(=O)NC1=NC(=CS1)CC(=O)O)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H21N3O5S/c1-11(2)21(17(25)12-4-6-14(26-3)7-5-12)9-15(22)20-18-19-13(10-27-18)8-16(23)24/h4-7,10-11H,8-9H2,1-3H3,(H,23,24)(H,19,20,22)