6-cyclohexyl-4-(2-morpholin-4-ylethyl)-5-(4-phenylmethoxyphenyl)thieno[3,2-b]pyrrole-2-carboxylic acid

Systemtic Name: 6-cyclohexyl-4-(2-morpholin-4-ylethyl)-5-(4-phenylmethoxyphenyl)thieno[3,2-b]pyrrole-2-carboxylic acid Openeye Name: 5-(4-benzyloxyphenyl)-6-cyclohexyl-4-(2-morpholinoethyl)thieno[3,2-b]pyrrole-2-carboxylic acid CAS Name: 6-cyclohexyl-4-[2-(4-morpholinyl)ethyl]-5-(4-phenylmethoxyphenyl)-2-thieno[3,2-b]pyrrolecarboxylic acid IUPAC Name: 6-cyclohexyl-4-(2-morpholin-4-ylethyl)-5-(4-phenylmethoxyphenyl)thieno[3,2-b]pyrrole-2-carboxylic acid Traditional Name: 5-(4-benzoxyphenyl)-6-cyclohexyl-4-(2-morpholinoethyl)thieno[3,2-b]pyrrole-2-carboxylic acid Formula: C32H36N2O4S MolecularWeight: 544.70424

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2SC(=C3)C(=O)O)CCN4CCOCC4)C5=CC=C(C=C5)OCC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2SC(=C3)C(=O)O)CCN4CCOCC4)C5=CC=C(C=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C32H36N2O4S/c35-32(36)28-21-27-31(39-28)29(24-9-5-2-6-10-24)30(34(27)16-15-33-17-19-37-20-18-33)25-11-13-26(14-12-25)38-22-23-7-3-1-4-8-23/h1,3-4,7-8,11-14,21,24H,2,5-6,9-10,15-20,22H2,(H,35,36)