2-[[4-[(3-carboxy-5-ethyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoyl]amino]-5-ethyl-thiophene-3-carboxylic acid

Systemtic Name: 2-[[4-[(3-carboxy-5-ethyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoyl]amino]-5-ethyl-thiophene-3-carboxylic acid Openeye Name: 2-[[4-[(3-carboxy-5-ethyl-2-thienyl)amino]-4-oxo-butanoyl]amino]-5-ethyl-thiophene-3-carboxylic acid CAS Name: 2-[[4-[(3-carboxy-5-ethyl-2-thiophenyl)amino]-1,4-dioxobutyl]amino]-5-ethyl-3-thiophenecarboxylic acid IUPAC Name: 2-[[4-[(3-carboxy-5-ethylthiophen-2-yl)amino]-4-oxobutanoyl]amino]-5-ethylthiophene-3-carboxylic acid Traditional Name: 2-[[4-[(3-carboxy-5-ethyl-2-thienyl)amino]-4-keto-butanoyl]amino]-5-ethyl-3-thenoic acid Formula: C18H20N2O6S2 MolecularWeight: 424.4912

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CCC(=O)NC2=C(C=C(S2)CC)C(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CCC(=O)NC2=C(C=C(S2)CC)C(=O)O)C(=O)O

InChI

InChI=1S/C18H20N2O6S2/c1-3-9-7-11(17(23)24)15(27-9)19-13(21)5-6-14(22)20-16-12(18(25)26)8-10(4-2)28-16/h7-8H,3-6H2,1-2H3,(H,19,21)(H,20,22)(H,23,24)(H,25,26)