2-[4-(4-methylphenyl)-2-(2-thiophen-2-ylethanoylamino)-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-(4-methylphenyl)-2-(2-thiophen-2-ylethanoylamino)-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-(p-tolyl)-2-[[2-(2-thienyl)acetyl]amino]thiazol-5-yl]acetic acid CAS Name: 2-[4-(4-methylphenyl)-2-[(1-oxo-2-thiophen-2-ylethyl)amino]-5-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-methylphenyl)-2-[(2-thiophen-2-ylacetyl)amino]-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-(p-tolyl)-2-[[2-(2-thienyl)acetyl]amino]thiazol-5-yl]acetic acid Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CC3=CC=CS3)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CC3=CC=CS3)CC(=O)O

InChI

InChI=1S/C18H16N2O3S2/c1-11-4-6-12(7-5-11)17-14(10-16(22)23)25-18(20-17)19-15(21)9-13-3-2-8-24-13/h2-8H,9-10H2,1H3,(H,22,23)(H,19,20,21)