ethyl 6-cyclohexyl-4-methyl-5-(4-phenylmethoxyphenyl)thieno[3,2-b]pyrrole-2-carboxylate

Systemtic Name: ethyl 6-cyclohexyl-4-methyl-5-(4-phenylmethoxyphenyl)thieno[3,2-b]pyrrole-2-carboxylate Openeye Name: ethyl 5-(4-benzyloxyphenyl)-6-cyclohexyl-4-methyl-thieno[3,2-b]pyrrole-2-carboxylate CAS Name: 6-cyclohexyl-4-methyl-5-(4-phenylmethoxyphenyl)-2-thieno[3,2-b]pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-cyclohexyl-4-methyl-5-(4-phenylmethoxyphenyl)thieno[3,2-b]pyrrole-2-carboxylate Traditional Name: 5-(4-benzoxyphenyl)-6-cyclohexyl-4-methyl-thieno[3,2-b]pyrrole-2-carboxylic acid ethyl ester Formula: C29H31NO3S MolecularWeight: 473.62634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C(=C(N2C)C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C(=C(N2C)C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C29H31NO3S/c1-3-32-29(31)25-18-24-28(34-25)26(21-12-8-5-9-13-21)27(30(24)2)22-14-16-23(17-15-22)33-19-20-10-6-4-7-11-20/h4,6-7,10-11,14-18,21H,3,5,8-9,12-13,19H2,1-2H3