4-[[3-ethoxycarbonyl-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-ethoxycarbonyl-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-ethoxycarbonyl-4-(4-isobutylphenyl)-5-methyl-2-thienyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[3-ethoxycarbonyl-5-methyl-4-[4-(2-methylpropyl)phenyl]-2-thiophenyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[3-ethoxycarbonyl-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophen-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[3-carbethoxy-4-(4-isobutylphenyl)-5-methyl-2-thienyl]amino]-4-keto-butyric acid Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)CC(C)C)C)NC(=O)CCC(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)CC(C)C)C)NC(=O)CCC(=O)O

InChI

InChI=1S/C22H27NO5S/c1-5-28-22(27)20-19(16-8-6-15(7-9-16)12-13(2)3)14(4)29-21(20)23-17(24)10-11-18(25)26/h6-9,13H,5,10-12H2,1-4H3,(H,23,24)(H,25,26)