2-[1-[[5-ethyl-3-(4-methoxyphenyl)carbonyl-thiophen-2-yl]amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-[[5-ethyl-3-(4-methoxyphenyl)carbonyl-thiophen-2-yl]amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoic acid Openeye Name: 2-[2-[[5-ethyl-3-(4-methoxybenzoyl)-2-thienyl]amino]-1-methyl-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[1-[[5-ethyl-3-[(4-methoxyphenyl)-oxomethyl]-2-thiophenyl]amino]-1-oxopropan-2-yl]thio]acetic acid IUPAC Name: 2-[1-[[5-ethyl-3-(4-methoxybenzoyl)thiophen-2-yl]amino]-1-oxopropan-2-yl]sulfanylacetic acid Traditional Name: 2-[[2-[(5-ethyl-3-p-anisoyl-2-thienyl)amino]-2-keto-1-methyl-ethyl]thio]acetic acid Formula: C19H21NO5S2 MolecularWeight: 407.50374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C(C)SCC(=O)O)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C(C)SCC(=O)O)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H21NO5S2/c1-4-14-9-15(17(23)12-5-7-13(25-3)8-6-12)19(27-14)20-18(24)11(2)26-10-16(21)22/h5-9,11H,4,10H2,1-3H3,(H,20,24)(H,21,22)