tert-butyl 4-[2-[6-(2,5-dimethylpyrrol-1-yl)-4-methyl-pyridin-2-yl]ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[6-(2,5-dimethylpyrrol-1-yl)-4-methyl-pyridin-2-yl]ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[6-(2,5-dimethylpyrrol-1-yl)-4-methyl-2-pyridyl]ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[6-(2,5-dimethyl-1-pyrrolyl)-4-methyl-2-pyridinyl]ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[6-(2,5-dimethylpyrrol-1-yl)-4-methylpyridin-2-yl]ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[6-(2,5-dimethylpyrrol-1-yl)-4-methyl-2-pyridyl]ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H34N4O2 MolecularWeight: 398.54166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC(=CC(=N2)CCN3CCN(CC3)C(=O)OC(C)(C)C)C)C

Isomeric SMILES

CC1=CC=C(N1C2=CC(=CC(=N2)CCN3CCN(CC3)C(=O)OC(C)(C)C)C)C

InChI

InChI=1S/C23H34N4O2/c1-17-15-20(24-21(16-17)27-18(2)7-8-19(27)3)9-10-25-11-13-26(14-12-25)22(28)29-23(4,5)6/h7-8,15-16H,9-14H2,1-6H3