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

Systemtic Name: 6-cyclohexyl-4-(2-methoxyethyl)-5-(4-phenylmethoxyphenyl)thieno[3,2-b]pyrrole-2-carboxylic acid Openeye Name: 5-(4-benzyloxyphenyl)-6-cyclohexyl-4-(2-methoxyethyl)thieno[3,2-b]pyrrole-2-carboxylic acid CAS Name: 6-cyclohexyl-4-(2-methoxyethyl)-5-(4-phenylmethoxyphenyl)-2-thieno[3,2-b]pyrrolecarboxylic acid IUPAC Name: 6-cyclohexyl-4-(2-methoxyethyl)-5-(4-phenylmethoxyphenyl)thieno[3,2-b]pyrrole-2-carboxylic acid Traditional Name: 5-(4-benzoxyphenyl)-6-cyclohexyl-4-(2-methoxyethyl)thieno[3,2-b]pyrrole-2-carboxylic acid Formula: C29H31NO4S MolecularWeight: 489.62574

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C(=C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCCC5)SC(=C2)C(=O)O

Isomeric SMILES

COCCN1C2=C(C(=C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCCC5)SC(=C2)C(=O)O

InChI

InChI=1S/C29H31NO4S/c1-33-17-16-30-24-18-25(29(31)32)35-28(24)26(21-10-6-3-7-11-21)27(30)22-12-14-23(15-13-22)34-19-20-8-4-2-5-9-20/h2,4-5,8-9,12-15,18,21H,3,6-7,10-11,16-17,19H2,1H3,(H,31,32)