2-(4-cyclopropylcarbonylpiperazin-1-yl)-1-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]ethanone

Systemtic Name: 2-(4-cyclopropylcarbonylpiperazin-1-yl)-1-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]ethanone Openeye Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-1-[2,5-dimethyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]ethanone CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-1-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)-3-pyrrolyl]ethanone IUPAC Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-1-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]ethanone Traditional Name: 2-[4-(cyclopropanecarbonyl)piperazino]-1-[2,5-dimethyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]ethanone Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CS2)C)C(=O)CN3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CS2)C)C(=O)CN3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C22H29N3O2S/c1-16-14-20(17(2)25(16)8-7-19-4-3-13-28-19)21(26)15-23-9-11-24(12-10-23)22(27)18-5-6-18/h3-4,13-14,18H,5-12,15H2,1-2H3