2-[[6-[(3-carboxy-5-methyl-thiophen-2-yl)amino]-6-oxidanylidene-hexanoyl]amino]-5-methyl-thiophene-3-carboxylic acid

Systemtic Name: 2-[[6-[(3-carboxy-5-methyl-thiophen-2-yl)amino]-6-oxidanylidene-hexanoyl]amino]-5-methyl-thiophene-3-carboxylic acid Openeye Name: 2-[[6-[(3-carboxy-5-methyl-2-thienyl)amino]-6-oxo-hexanoyl]amino]-5-methyl-thiophene-3-carboxylic acid CAS Name: 2-[[6-[(3-carboxy-5-methyl-2-thiophenyl)amino]-1,6-dioxohexyl]amino]-5-methyl-3-thiophenecarboxylic acid IUPAC Name: 2-[[6-[(3-carboxy-5-methylthiophen-2-yl)amino]-6-oxohexanoyl]amino]-5-methylthiophene-3-carboxylic acid Traditional Name: 2-[[6-[(3-carboxy-5-methyl-2-thienyl)amino]-6-keto-hexanoyl]amino]-5-methyl-3-thenoic acid Formula: C18H20N2O6S2 MolecularWeight: 424.4912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)CCCCC(=O)NC2=C(C=C(S2)C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)CCCCC(=O)NC2=C(C=C(S2)C)C(=O)O)C(=O)O

InChI

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