ethyl 4-[6-[(4-methylphenyl)methyl]thieno[2,3-b]pyrrol-5-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-[(4-methylphenyl)methyl]thieno[2,3-b]pyrrol-5-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[6-(p-tolylmethyl)thieno[2,3-b]pyrrole-5-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[6-[(4-methylphenyl)methyl]-5-thieno[2,3-b]pyrrolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-[(4-methylphenyl)methyl]thieno[2,3-b]pyrrole-5-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[6-(4-methylbenzyl)thieno[2,3-b]pyrrole-5-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(N2CC4=CC=C(C=C4)C)SC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(N2CC4=CC=C(C=C4)C)SC=C3

InChI

InChI=1S/C22H25N3O3S/c1-3-28-22(27)24-11-9-23(10-12-24)20(26)19-14-18-8-13-29-21(18)25(19)15-17-6-4-16(2)5-7-17/h4-8,13-14H,3,9-12,15H2,1-2H3