1-[(2S)-4-(6-ethylthieno[2,3-b]pyrrol-5-yl)carbonyl-2-methyl-piperazin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[(2S)-4-(6-ethylthieno[2,3-b]pyrrol-5-yl)carbonyl-2-methyl-piperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[(2S)-4-(6-ethylthieno[2,3-b]pyrrole-5-carbonyl)-2-methyl-piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[(2S)-4-[(6-ethyl-5-thieno[2,3-b]pyrrolyl)-oxomethyl]-2-methyl-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[(2S)-4-(6-ethylthieno[2,3-b]pyrrole-5-carbonyl)-2-methylpiperazin-1-yl]-2-phenoxyethanone Traditional Name: 1-[(2S)-4-(6-ethylthieno[2,3-b]pyrrole-5-carbonyl)-2-methyl-piperazino]-2-phenoxy-ethanone Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1SC=C2)C(=O)N3CCN(C(C3)C)C(=O)COC4=CC=CC=C4

Isomeric SMILES

CCN1C(=CC2=C1SC=C2)C(=O)N3CCN([C@H](C3)C)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O3S/c1-3-24-19(13-17-9-12-29-22(17)24)21(27)23-10-11-25(16(2)14-23)20(26)15-28-18-7-5-4-6-8-18/h4-9,12-13,16H,3,10-11,14-15H2,1-2H3/t16-/m0/s1