tert-butyl 3-(2-methyl-3-thiophen-2-yl-pyrazolo[1,5-a]pyrimidin-7-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-(2-methyl-3-thiophen-2-yl-pyrazolo[1,5-a]pyrimidin-7-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 3-[2-methyl-3-(2-thienyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperidine-1-carboxylate CAS Name: 3-(2-methyl-3-thiophen-2-yl-7-pyrazolo[1,5-a]pyrimidinyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-methyl-3-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidine-1-carboxylate Traditional Name: 3-[2-methyl-3-(2-thienyl)pyrazolo[1,5-a]pyrimidin-7-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=CC=NC2=C1C3=CC=CS3)C4CCCN(C4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=NN2C(=CC=NC2=C1C3=CC=CS3)C4CCCN(C4)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H26N4O2S/c1-14-18(17-8-6-12-28-17)19-22-10-9-16(25(19)23-14)15-7-5-11-24(13-15)20(26)27-21(2,3)4/h6,8-10,12,15H,5,7,11,13H2,1-4H3