1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanone

Systemtic Name: 1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-benzoylpiperazin-1-yl)-1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)ethanone CAS Name: 2-(4-benzoyl-1-piperazinyl)-1-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]ethanone IUPAC Name: 2-(4-benzoylpiperazin-1-yl)-1-(1-benzyl-2,5-dimethylpyrrol-3-yl)ethanone Traditional Name: 2-(4-benzoylpiperazino)-1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)ethanone Formula: C26H29N3O2 MolecularWeight: 415.52736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)CN3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)CN3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O2/c1-20-17-24(21(2)29(20)18-22-9-5-3-6-10-22)25(30)19-27-13-15-28(16-14-27)26(31)23-11-7-4-8-12-23/h3-12,17H,13-16,18-19H2,1-2H3