ethyl 6-cyclohex-2-en-1-yl-5-(4-phenylmethoxyphenyl)-4H-thieno[3,2-b]pyrrole-2-carboxylate

Systemtic Name: ethyl 6-cyclohex-2-en-1-yl-5-(4-phenylmethoxyphenyl)-4H-thieno[3,2-b]pyrrole-2-carboxylate Openeye Name: ethyl 5-(4-benzyloxyphenyl)-6-cyclohex-2-en-1-yl-4H-thieno[3,2-b]pyrrole-2-carboxylate CAS Name: 6-(1-cyclohex-2-enyl)-5-(4-phenylmethoxyphenyl)-4H-thieno[3,2-b]pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-cyclohex-2-en-1-yl-5-(4-phenylmethoxyphenyl)-4H-thieno[3,2-b]pyrrole-2-carboxylate Traditional Name: 5-(4-benzoxyphenyl)-6-cyclohex-2-en-1-yl-4H-thieno[3,2-b]pyrrole-2-carboxylic acid ethyl ester Formula: C28H27NO3S MolecularWeight: 457.58388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C(=C(N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCC=C5

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C(=C(N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCC=C5

InChI

InChI=1S/C28H27NO3S/c1-2-31-28(30)24-17-23-27(33-24)25(20-11-7-4-8-12-20)26(29-23)21-13-15-22(16-14-21)32-18-19-9-5-3-6-10-19/h3,5-7,9-11,13-17,20,29H,2,4,8,12,18H2,1H3