6-cyclohexyl-5-(4-methanoylphenyl)-4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)thieno[3,2-b]pyrrole-2-carboxylic acid

Systemtic Name: 6-cyclohexyl-5-(4-methanoylphenyl)-4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)thieno[3,2-b]pyrrole-2-carboxylic acid Openeye Name: 6-cyclohexyl-5-(4-formylphenyl)-4-(2-morpholino-2-oxo-ethyl)thieno[3,2-b]pyrrole-2-carboxylic acid CAS Name: 6-cyclohexyl-5-(4-formylphenyl)-4-[2-(4-morpholinyl)-2-oxoethyl]-2-thieno[3,2-b]pyrrolecarboxylic acid IUPAC Name: 6-cyclohexyl-5-(4-formylphenyl)-4-(2-morpholin-4-yl-2-oxoethyl)thieno[3,2-b]pyrrole-2-carboxylic acid Traditional Name: 6-cyclohexyl-5-(4-formylphenyl)-4-(2-keto-2-morpholino-ethyl)thieno[3,2-b]pyrrole-2-carboxylic acid Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2SC(=C3)C(=O)O)CC(=O)N4CCOCC4)C5=CC=C(C=C5)C=O

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2SC(=C3)C(=O)O)CC(=O)N4CCOCC4)C5=CC=C(C=C5)C=O

InChI

InChI=1S/C26H28N2O5S/c29-16-17-6-8-19(9-7-17)24-23(18-4-2-1-3-5-18)25-20(14-21(34-25)26(31)32)28(24)15-22(30)27-10-12-33-13-11-27/h6-9,14,16,18H,1-5,10-13,15H2,(H,31,32)